CHEBI:224686 - Trichocadinin E

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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 Trichocadinin E
ChEBI ID CHEBI:224686
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O3
Net Charge 0
Average Mass 250.338
Monoisotopic Mass 250.15689
InChI InChI=1S/C15H22O3/c1-8(2)11-5-4-9(3)14-12(11)6-10(15(17)18)7-13(14)16/h6,8,11-14,16H,3-5,7H2,1-2H3,(H,17,18)/t11-,12+,13+,14-/m0/s1
InChIKey BRZGUFNKBGZBHW-DGAVXFQQSA-N
SMILES O=C(O)C1=C[C@H]2[C@H](C(=C)CC[C@H]2C(C)C)[C@@H](C1)O
Metabolite of Species Details
Trichoderma (NCBI:txid5543) See: PubMed
ChEBI Ontology
Outgoing Trichocadinin E (CHEBI:224686) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(4R,4aR,8S,8aS)-4-hydroxy-5-methylidene-8-propan-2-yl-4,4a,6,7,8,8a-hexahydro-3H-naphthalene-2-carboxylic acid