Trichocadinin K (CHEBI:214142)

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CHEBI:214142 - Trichocadinin K

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ChEBI ID	CHEBI:214142
ChEBI Name	Trichocadinin K
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H24O4
Net Charge	0
Average Mass	280.364
Monoisotopic Mass	280.16746
SMILES	COC(=O)C1=C[C@]23OC[C@@H](C)[C@H]2CC[C@H](C)[C@@H]3[C@@H](O)C1
InChI	InChI=1S/C16H24O4/c1-9-4-5-12-10(2)8-20-16(12)7-11(15(18)19-3)6-13(17)14(9)16/h7,9-10,12-14,17H,4-6,8H2,1-3H3/t9-,10+,12+,13-,14+,16-/m0/s1
InChIKey	UVWAFFLOXZSORH-MWYQURTMSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma (ncbitaxon:5543)	-	PubMed (32861754)

ChEBI Ontology

Outgoing Relation(s)
	Trichocadinin K (CHEBI:214142) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
methyl (3S,3aR,6S,6aR,7S,10aR)-7-hydroxy-3,6-dimethyl-3,3a,4,5,6,6a,7,8-octahydro-2H-benzo[h][1]benzouran-9-carboxylate

Manual Xrefs	Databases
98309181	ChemSpider