EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70311 - antcin A

ChEBI IDCHEBI:70311
ChEBI Nameantcin A
Stars
DefinitionA natural product found in Taiwanofungus camphoratus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC29H42O4
Net Charge0
Average Mass454.651
Monoisotopic Mass454.30831
SMILES[H][C@@]12CC[C@]([H])([C@H](C)CCC(=C)[C@H](C)C(=O)O)[C@@]1(C)CC(=O)C1=C2CC[C@@]2([H])[C@H](C)C(=O)CC[C@]12C
InChIInChI=1S/C29H42O4/c1-16(18(3)27(32)33)7-8-17(2)21-11-12-23-20-9-10-22-19(4)24(30)13-14-28(22,5)26(20)25(31)15-29(21,23)6/h17-19,21-23H,1,7-15H2,2-6H3,(H,32,33)/t17-,18+,19+,21-,22+,23+,28+,29-/m1/s1
InChIKeyWTSUWKBKPMVEBO-QNMMDLTMSA-N
Species of MetaboliteComponentSourceComments
Taiwanofungus camphoratus (ncbitaxon:196114) fruit body (BTO:0000487) PubMed (21028898) Parasitic to the inner heartwood wall of old hollow trunks of Cinnamomum kanehirai, EtOH extract
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
antcin A (CHEBI:70311) has role metabolite (CHEBI:25212)
antcin A (CHEBI:70311) is a ergostanoid (CHEBI:50403)
Synonym  Source
(4alpha,5alpha,25S)-4-Methyl-3,11-dioxoergosta-8,24(28)-dien-26-oic acidChEBI
Citations