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CHEBI:70300 - Camphoratin A, (rel)-

ChEBI IDCHEBI:70300
ChEBI NameCamphoratin A, (rel)-
Stars
DefinitionA natural product found in Taiwanofungus camphoratus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC29H44O6
Net Charge0
Average Mass488.665
Monoisotopic Mass488.31379
SMILES[H][C@@]12CC[C@]([H])([C@H](C)CCC(=C)C(C)C(=O)O)[C@@]1(C)[C@@H](O)C(=O)C1=C2[C@@H](O)C[C@@]2([H])[C@H](C)[C@H](O)CC[C@]12C
InChIInChI=1S/C29H44O6/c1-14(16(3)27(34)35)7-8-15(2)18-9-10-19-23-22(31)13-20-17(4)21(30)11-12-28(20,5)24(23)25(32)26(33)29(18,19)6/h15-22,26,30-31,33H,1,7-13H2,2-6H3,(H,34,35)/t15-,16?,17+,18-,19+,20+,21-,22+,26+,28+,29-/m1/s1
InChIKeyFNVQVQLJUASNQK-QTDSDZRTSA-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
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
Camphoratin A, (rel)- (CHEBI:70300) has role metabolite (CHEBI:25212)
Camphoratin A, (rel)- (CHEBI:70300) is a bile acid (CHEBI:3098)
Synonym  Source
rel-3alpha,7beta,11alpha-trihydroxy-11-oxo-4alpha-methylergosta-8,24(28)-dien-26-oic acidChEBI
Citations