CHEBI:132370 - triptotriterpenic acid A

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ChEBI Name triptotriterpenic acid A
ChEBI ID CHEBI:132370
Definition A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium hypoglaucum.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C30H48O4
Net Charge 0
Average Mass 472.701
Monoisotopic Mass 472.35526
InChI InChI=1S/C30H48O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,22-,23-,26-,27+,28-,29+,30+/m0/s1
InChIKey JTBGJQZJEYVBJZ-YLXTXNMFSA-N
SMILES C1[C@H](O)C([C@@]2(CC[C@@]3([C@](CC=C4[C@]3(CC[C@@]5([C@]4(C[C@@](C[C@@H]5O)(C(O)=O)C)[H])C)C)([C@]2(C1)C)[H])C)[H])(C)C
Metabolite of Species Details
Euonymus laxiflorus (NCBI:txid1009469) Found in leaf (BTO:0000713). See: PubMed
Euonymus laxiflorus (NCBI:txid1009469) Found in stem (BTO:0001300). See: PubMed
Tripterygium hypoglaucum (NCBI:txid205465) See: PubMed
Begonia nantoensis (NCBI:txid78253) Found in rhizome (BTO:0001181). See: PubMed
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing triptotriterpenic acid A (CHEBI:132370) has parent hydride oleanane (CHEBI:36481)
triptotriterpenic acid A (CHEBI:132370) has role plant metabolite (CHEBI:76924)
triptotriterpenic acid A (CHEBI:132370) is a diol (CHEBI:23824)
triptotriterpenic acid A (CHEBI:132370) is a hydroxy monocarboxylic acid (CHEBI:35868)
triptotriterpenic acid A (CHEBI:132370) is a pentacyclic triterpenoid (CHEBI:25872)
IUPAC Name
(3β,22α)-3,22-dihydroxyolean-12-en-29-oic acid
Synonyms Sources
3,22-Dihydroxyolean-12-en-29-oic acid ChemIDplus
3β,22α-dihydroxyolean-12-en-29-oic acid ChEBI
Registry Numbers Types Sources
100897-87-8 CAS Registry Number ChemIDplus
5857675 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
12713415 PubMed citation Europe PMC
14993759 PubMed citation Europe PMC
535601 Chinese Abstracts citation Europe PMC
Last Modified
24 October 2016