CHEBI:67798 - 3-O-[alpha-L-arabinopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl oleanolic acid

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ChEBI Name 3-O-[alpha-L-arabinopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl oleanolic acid
ChEBI ID CHEBI:67798
Definition A natural product found in Albizia inundata.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C43H69NO12
Net Charge 0
Average Mass 792.00750
Monoisotopic Mass 791.48198
InChI InChI=1S/C43H69NO12/c1-22(45)44-30-33(49)32(48)26(21-54-36-34(50)31(47)25(46)20-53-36)55-35(30)56-29-12-13-40(6)27(39(29,4)5)11-14-42(8)28(40)10-9-23-24-19-38(2,3)15-17-43(24,37(51)52)18-16-41(23,42)7/h9,24-36,46-50H,10-21H2,1-8H3,(H,44,45)(H,51,52)/t24-,25-,26+,27-,28+,29-,30+,31-,32+,33+,34+,35-,36-,40-,41+,42+,43-/m0/s1
InChIKey MBMJMOODCJFAET-NLZUOQEQSA-N
SMILES [H][C@]1(OC[C@H](O)[C@H](O)[C@H]1O)OC[C@H]1O[C@@]([H])(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C2(C)C)[C@H](NC(C)=O)[C@@H](O)[C@@H]1O
Metabolite of Species Details
Albizia inundata (IPNI:989452-1) Found in aerial part (BTO:0001658). CH2Cl2-MeOH (1:1) extract of dried,ground biomass See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
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ChEBI Ontology
Outgoing 3-O-[alpha-L-arabinopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl oleanolic acid (CHEBI:67798) has role metabolite (CHEBI:25212)
3-O-[alpha-L-arabinopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl oleanolic acid (CHEBI:67798) is a triterpenoid saponin (CHEBI:61778)
Citation Waiting for Citations Type Source
21314099 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:triterpenoid(CHEBI:36615); ISA:O-acyl carbohydrate(CHEBI:52782); ISA:N-acyl-hexosamine(CHEBI:21656); ISA:disaccharide(CHEBI:36233); ISA:glycoside(CHEBI:24400); ISA:amino sugar(CHEBI:28963); ISA:oxanes(CHEBI:46942); ISA:carboxamide(CHEBI:37622); ISA:polyol(CHEBI:26191); ISA:secondary alcohol(CHEBI:35681); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:acetal(CHEBI:59769); ISA:amine(CHEBI:32952); ISA:carbonyl compound(CHEBI:36586);