- Compound ID: 23615
Structure type: oligomer
Reference(s) to other database(s): CCSD:
13760, CBank-STR:5535
- Compound ID: 23708
|
b-D-Glcp-(1-28)-+
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
Trivial name: Betavulgaroside III
Reference(s) to other database(s): CCSD:
15194, CBank-STR:10950
- Compound ID: 23709
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
Trivial name: Betavulgaroside IV
Reference(s) to other database(s): CCSD:
15199, CBank-STR:10992
- Compound ID: 23829
|
b-D-Glcp-(1-28)-+
|
b-D-Xylp-(1-3)-b-D-GlcpA-(1-3)-Subst
Subst = 30-norolean-12,20(29)-dien-3β-ol-28-oic acid = SMILES CC(C)([C@](CC[C@@]([C@](CC[C@@](CC1)2{28}C(O)=O)3C)4C)5[H]){3}[C@@H](O)CC[C@]5(C)[C@@]4([H])CC=C3[C@]2([H])CC1=C |
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Structure type: oligomer
; 909 [M-H]-
C46H70O18
Trivial name: betavulgaroside X
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
15700, CBank-STR:15893
- Compound ID: 23830
|
b-D-Glcp-(1-28)-+
|
Subst-(2-4:3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,2',3-trihydroxy-hexane-1,6-dioic acid = SMILES O=C(O){2}C(O)(O){3}[CH](O)CCC(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside I
Compound class: saponin glycoside
- Compound ID: 23831
|
Subst-(2-4:3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,2',3-trihydroxy-hexane-1,6-dioic acid = SMILES O=C(O){2}C(O)(O){3}[CH](O)CCC(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside II
Compound class: saponin glycoside
- Compound ID: 23832
|
b-D-Glcp-(1-28)-+
|
Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,3-dihydroxy-3'-carboxymethoxy-propionic acid = SMILES O=C(O)C(O){3}[CH](O)OCC(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside III
Compound class: saponin glycoside
- Compound ID: 23833
|
Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,3-dihydroxy-3'-carboxymethoxyl-propionic acid = SMILES O=C(O)C(O){3}[CH](O)OCC(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
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Structure type: oligomer
Trivial name: betavulgaroside IV
Compound class: saponin glycoside
- Compound ID: 23834
|
b-D-Glcp-(1-28)-+
|
b-D-Glcp-(1-2)-+ |
| |
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O;
xXOleanolic = 3β-hydroxyolean-12-en-28-oic acid |
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Structure type: oligomer
; 1117 [M-H]-, 1141.5034 [M+Na]+
C53H82O25
Trivial name: betavulgaroside V
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
16563, CBank-STR:22240
- Compound ID: 23835
|
b-D-Glcp-(1-28)-+
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Hederagenin
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O |
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Structure type: oligomer
; 971 [M-H]-, 995.4437 [M+Na]+
C47H72O21
Trivial name: betavulgaroside VI
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
16564, CBank-STR:22241
- Compound ID: 23836
|
b-D-Glcp-(1-28)-+
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Subst1
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O;
Subst1 = 30-norolean-12,20(29)-dien-3β-ol-28-oic acid = SMILES CC(C)([C@](CC[C@@]([C@](CC[C@@](CC1)2{28}C(O)=O)3C)4C)5[H]){3}[C@@H](O)CC[C@]5(C)[C@@]4([H])CC=C3[C@]2([H])CC1=C |
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Structure type: oligomer
; 939 [M-H]-, 963.4185 [M+Na]+
C46H68O20
Trivial name: betavulgaroside VIII
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
16565, CBank-STR:22242
- Compound ID: 23837
|
b-D-Glcp-(1-28)-+
|
b-D-Xylp-(1-2)-+ |
| |
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
; 1089 [M-H]-, 1111.4934 [M+Na]+
C52H80O24
Trivial name: betavulgaroside IX
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
16646, CBank-STR:22243
- Compound ID: 23838
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Hederagenin
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O |
Show graphically |
Structure type: oligomer
; 809 [M-H]-, 833.3952 [M+Na]+
C41H62O16
Trivial name: betavulgaroside VII
Compound class: saponin glycoside
Reference(s) to other database(s): CBank-STR:13505
- Compound ID: 24141
Structure type: polymer chemical repeating unit
Trivial name: rhamnogalactouronan
Compound class: rhamnogalactournonan
Reference(s) to other database(s): GTC:G28839TI, CCSD:
50038, CBank-STR:3824
- Compound ID: 25411
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34571, CBank-STR:1590
- Compound ID: 25412
|
Fer-(9-?)-a-L-Araf-(1-3)-a-L-Araf-(1-5)-L-Araf
Fer = ferulic acid |
Show graphically |
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34572, CBank-STR:2837
- Compound ID: 25413
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34573, CBank-STR:3749
- Compound ID: 25414
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34574, CBank-STR:1590
- Compound ID: 25415
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34574, CBank-STR:1590
- Compound ID: 25416
Structure type: oligomer
- Compound ID: 25417
Structure type: oligomer
- Compound ID: 25420
|
Fer-(9-2)-+
|
a-L-Araf-(1-3)-a-L-Araf-(1-5)-a-L-Araf
Fer = trans-ferulic acid |
Show graphically |
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34575, CBank-STR:2837
- Compound ID: 25421
|
Fer-(9-2)-+
|
a-L-Araf-(1-3)-a-L-Araf-(1-5)-b-L-Araf
Fer = trans-ferulic acid |
Show graphically |
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34575, CBank-STR:2837
- Compound ID: 25422
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34576, CBank-STR:3749
- Compound ID: 25423
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34576, CBank-STR:3749
- Compound ID: 25424
Structure type: oligomer
Compound class: cell wall polysaccharide
Reference(s) to other database(s): CCSD:
34577, CBank-STR:1590
- Compound ID: 25425
Structure type: oligomer
- Compound ID: 25427
Structure type: oligomer
Reference(s) to other database(s): CCSD:
34578, CBank-STR:3749
- Compound ID: 25428
|
Fer-(9-2)-+
|
a-L-Araf-(1-3)-a-L-Araf-(1-5)-L-Araf
Fer = trans-ferulic acid |
Show graphically |
Structure type: oligomer
Compound class: cell wall polysaccharide
Reference(s) to other database(s): CCSD:
34579, CBank-STR:2837
- Compound ID: 26572
|
Subst1-(1'-3)-+
|
b-D-Glcp-(1-28)-Oleanolic
Subst1 = 3-hydroxy-6-oxo-1,4-dioxane-2-carboxylic acid = SMILES O={53}C(C({51}C(O)OC1)OC1=O)O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: monomer
; 785 [M+Na]+
C41H62O13
Compound class: saponin glycoside
Reference(s) to other database(s): CCSD:
49873, CBank-STR:1390
- Compound ID: 26573
|
b-D-Glcp2Ac3Ac4Ac6Ac-(1-28)-+
|
Subst1-(3-3)-b-D-GlcpA2Ac4Ac6Me-(1-3)-Oleanolic
Subst1 = methyl 2-acetoxy-3-hydroxy-3-(2-methoxy-2-oxoethoxy)propanoate = SMILES O=C(OC)C(OC(C)=O){3}C(O)OCC(OC)=O;
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
; 1317 [M+Na]+
Compound class: glycoside
Reference(s) to other database(s): CCSD:
49874, CBank-STR:4974
- Compound ID: 26574
|
b-D-Glcp2Ac3Ac4Ac6Ac-(1-28)-+
|
b-D-GlcpA2Ac3Ac4Ac6Me-(1-3)-Oleanolic
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
; 1125 [M+Na]+
Compound class: glycoside
- Compound ID: 24031
|
b-D-Glcp-(1-28)-+
|
b-D-Xylp-(1-3)-b-D-GlcpA-(1-3)-Oleanolic
Oleanolic = 3β-hydroxyolean-12-en-28-oic acid |
Show graphically |
Structure type: oligomer
C47H74O18
Trivial name: momordin IIc, quinoside D
Compound class: saponin glycoside, glycoside
Reference(s) to other database(s): CCSD:
20169, CBank-STR:7439
- Compound ID: 27015
Structure type: monomer
Compound class: cell wall polysaccharide
- Compound ID: 27858
Structure type: oligomer
; 577 [M+H]+
Reference(s) to other database(s): GTC:G13809LQ
- Compound ID: 27859
Structure type: oligomer
; 577 [M+H]+
Reference(s) to other database(s): GTC:G34568QA
- Compound ID: 27860
|
a-L-Rhap-(1-4)-+
|
a-L-Fucp2Me?(%)Ac-(1-2)-a-D-Galp-(1-2)-b-AcefA?Ac-(1-3)-b-L-Rhap-(1-3)-Apif |
Show graphically |
Structure type: oligomer
; 993, 951 [M-H]-
- Compound ID: 27861
Structure type: oligomer
Reference(s) to other database(s): GTC:G61147HV
- Compound ID: 27862
|
a-D-GalpA-(1-2)-+
|
a-D-Xylp2Me-(1-3)-+ |
| |
a-D-Galp-(1-2)-b-D-GlcpA-(1-4)-a-L-Fucp-(1-4)-b-L-Rhap-(1-3)-Apif
|
b-D-GalpA-(1-3)-+ |
Show graphically |
Structure type: oligomer
; 993, 951 [M-H]-
- Compound ID: 27890
|
a-L-Fucp2Me?Ac-(1-2)-+
|
b-L-Araf-(1-2)-a-L-Rhap-(1-2)-a-L-Arap-(1-4)-a-D-Galp-(1-2)-b-AcefA3Ac-(1-3)-b-D-Apif-(1-2)-+
|
b-L-Araf-(1-5)-D-3dlyxHepp-ulosaric-(2-3)-+ |
| |
a-L-Rhap-(1-5)-Kdo-(2-3)-+ | |
| | |
a-D-GalpA-(1-2)-+ | | |
| | | |
a-D-Xylp2Me-(1-3)-+ | | | |
| | | | |
a-D-Galp-(1-2)-b-D-GlcpA-(1-4)-b-L-Fucp-(1-4)-b-L-Rhap-(1-3)-b-D-Apif-(1-2)-+ | | |
| | | | |
b-D-GalpA-(1-3)-+ | | | |
| | | |
-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1-4)-a-D-GalpA-(1- |
Show graphically |
Structure type: polymer chemical repeating unit
- Compound ID: 28054
|
b-D-Glcp-(1-28)-+
|
b-D-Xylp-(1-3)-b-D-GlcpA-(1-3)-Subst2
Subst1 = 3-(carboxymethoxy)-2,3-dihydroxypropanoic acid = SMILES O=C(O)CO{3}C(O)C(O)C(=O)O;
Subst2 = akebonoic acid = SMILES C=C5CC[C@]4({28}C(=O)O)CC[C@]3(C)/C(=C\CC2[C@@]1(C)CC{3}[C@H](O)[C@](C)(C)C1CC[C@]23C)C4C5 |
Show graphically |
Structure type: oligomer
; 933.4514 [M+Na]+
C46H70O18
Trivial name: betavulgaroside X
Compound class: triterpene glycoside
- Compound ID: 28055
Structure type: monomer
Trivial name: compound O
Compound class: glycoside, triterpene glycoside, triterpenoid glycoside
- Compound ID: 28056
Structure type: monomer
Compound class: triterpene glycoside
- Compound ID: 28207
|
b-D-Xyl-(1-3)-+
|
b-D-Glcp-(1-2)-b-D-GlcpA-(1-3)-Subst
Subst = morolic acid = SMILES CC1(C){3}[C@@H](O)CC[C@]2(C)[C@@]3([H])CC[C@]4([H])C5=CC(C)(C)CC[C@@]({28}C(O)=O)5CC[C@](C)4[C@@](C)3CC[C@@]12[H] |
Show graphically |
Structure type: oligomer
Compound class: triterpenoid glycoside
- Compound ID: 30143
|
b-D-Glcp-(1-28)-+
|
Gc-(2-3)-Subst-(2-4:3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,3-dioxopropanoic acid acetal = SMILES [H]{3}[C@@](O)(O){2}[C@@](O)(O)C(=O)O |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside I
Compound class: saponin glycoside
- Compound ID: 30144
|
Gc-(2-3)-Subst-(2-4:3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = 2,3-dioxopropanoic acid acetal = SMILES [H]{3}[C@@](O)(O){2}[C@@](O)(O)C(=O)O |
Show graphically |
Structure type: monomer
Trivial name: betavulgaroside II
Compound class: saponin glycoside
- Compound ID: 30145
|
b-D-Glcp-(1-28)-+
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside III
Compound class: saponin glycoside
- Compound ID: 30146
|
Gc-(2-3')-Subst-(3-3)-b-D-GlcpA-(1-3)-Oleanolic
Subst = tartronaldehydic acid acetal = SMILES O[C@H]({3}[CH](O){53}O)C(O)=O |
Show graphically |
Structure type: monomer
Trivial name: betavulgaroside IV
Compound class: saponin glycoside
- Compound ID: 29002
Structure type: oligomer
Trivial name: momordin IIc
Compound class: saponin glycoside, glycoside, triterpene glycoside, triterpenoid glycoside
- Compound ID: 30148
|
b-D-Glcp-(1-28)-+
|
b-D-Xylp-(1-3)-b-D-GlcpA-(1-3)-Subst
Subst = 30-norolean-12,20(29)-dien-3β-ol-28-oic acid = SMILES CC(C)([C@](CC[C@@]([C@](CC[C@@](CC1)2{28}C(O)=O)3C)4C)5[H]){3}[C@@H](O)CC[C@]5(C)[C@@]4([H])CC=C3[C@]2([H])CC1=C |
Show graphically |
Structure type: oligomer
Trivial name: betavulgaroside X
Compound class: saponin glycoside
- Compound ID: 31296
|
b-D-Glcp-(1-5)-Subst
Subst = betanin = SMILES O{6}C(C=C1/2)={5}C(O)C=C1CC(C([O-])=O)[N+]2=C/C=C3C=C({20}C(O)=O)NC({19}C(O)=O)C/3 |
Show graphically |
Structure type: monomer
Trivial name: betanin
Compound class: glycoside
- Compound ID: 31324
Structure type: oligomer
Compound class: glycoside
Found 