CHEBI:211587 - Ochracine B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Ochracine B
ChEBI ID CHEBI:211587
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H26O4
Net Charge 0
Average Mass 258.358
Monoisotopic Mass 258.18311
InChI InChI=1S/C14H26O4/c1-10(16)14(18)7-6-13(2,3)11(8-14)4-5-12(17)9-15/h4,10,12,15-18H,5-9H2,1-3H3/b11-4+/t10-,12-,14+/m1/s1
InChIKey SEHYDASJUXGREN-KUACZAJLSA-N
SMILES O[C@]1([C@H](O)C)C/C(=C\C[C@@H](O)CO)/C(C)(C)CC1
Metabolite of Species Details
Steccherinum ochraceum (NCBI:txid92696) See: PubMed
ChEBI Ontology
Outgoing Ochracine B (CHEBI:211587) is a tertiary alcohol (CHEBI:26878)
IUPAC Name
(2R,4E)-4-[(5S)-5-hydroxy-5-[(1R)-1-hydroxyethyl]-2,2-dimethylcyclohexylidene]butane-1,2-diol