CHEBI:5634 - hederagenin 3-O-arabinoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name hederagenin 3-O-arabinoside
ChEBI ID CHEBI:5634
ChEBI ASCII Name hederagenin 3-O-arabinoside
Definition A triterpenoid saponin that is hederagenin attached to an α-L-arabinopyranosyl residue at position 3 via a glycosidic linkage.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C35H56O8
Net Charge 0
Average Mass 604.81430
Monoisotopic Mass 604.39752
InChI InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27+,28-,31-,32-,33+,34+,35-/m0/s1
InChIKey QUBNLZCADIYAFW-RITZIESXSA-N
SMILES CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing hederagenin 3-O-arabinoside (CHEBI:5634) has functional parent hederagenin (CHEBI:69579)
hederagenin 3-O-arabinoside (CHEBI:5634) has parent hydride oleanane (CHEBI:36481)
hederagenin 3-O-arabinoside (CHEBI:5634) has role plant metabolite (CHEBI:76924)
hederagenin 3-O-arabinoside (CHEBI:5634) is a α-L-arabinopyranoside (CHEBI:37782)
hederagenin 3-O-arabinoside (CHEBI:5634) is a hydroxy monocarboxylic acid (CHEBI:35868)
hederagenin 3-O-arabinoside (CHEBI:5634) is a monosaccharide derivative (CHEBI:63367)
hederagenin 3-O-arabinoside (CHEBI:5634) is a pentacyclic triterpenoid (CHEBI:25872)
hederagenin 3-O-arabinoside (CHEBI:5634) is a triterpenoid saponin (CHEBI:61778)
IUPAC Name
3β-(α-L-arabinopyranosyloxy)-23-hydroxyolean-12-en-28-oic acid
Synonyms Sources
3β-O-α-L-arabinopyranosyl hederagenin ChEBI
Cauloside A KEGG COMPOUND
Leontoside A ChemIDplus
Manual Xrefs Databases
C00003527 KNApSAcK
C08953 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
17184-21-3 CAS Registry Number ChemIDplus
4241078 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10319113 PubMed citation Europe PMC
19152225 PubMed citation Europe PMC
Last Modified
28 July 2014