CHEBI:132371 - triptocallic acid D

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ChEBI Name triptocallic acid D
Definition A pentacyclic triterpenoid with formula C30H48O4, originally isolated from Tripterygium wilfordii and 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
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
Tripterygium hypoglaucum (NCBI:txid205465) See: Phytochem., 53, (2000), 715
Tripterygium wilfordii (NCBI:txid458696) See: Phytochem., 53, (2000), 805
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 triptocallic acid D (CHEBI:132371) has parent hydride oleanane (CHEBI:36481)
triptocallic acid D (CHEBI:132371) has role plant metabolite (CHEBI:76924)
triptocallic acid D (CHEBI:132371) is a diol (CHEBI:23824)
triptocallic acid D (CHEBI:132371) is a hydroxy monocarboxylic acid (CHEBI:35868)
triptocallic acid D (CHEBI:132371) is a pentacyclic triterpenoid (CHEBI:25872)
(3α,22α)-3,22-dihydroxyolean-12-en-29-oic acid
Synonym Source
3α,22α-dihydroxyolean-12-en-29-oic acid ChEBI
Manual Xrefs Databases
44575705 PubChem
C00037953 KNApSAcK
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Registry Numbers Types Sources
201534-09-0 CAS Registry Number KNApSAcK
7891502 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
17250858 PubMed citation Europe PMC
Last Modified
25 October 2016