Trichocadinin L (CHEBI:214148)

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CHEBI:214148 - Trichocadinin L

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ChEBI ID	CHEBI:214148
ChEBI Name	Trichocadinin L
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H18O4
Net Charge	0
Average Mass	274.316
Monoisotopic Mass	274.12051
SMILES	COC(=O)c1cc2c3c(coc3c1)CC[C@@H]2C(C)(C)O
InChI	InChI=1S/C16H18O4/c1-16(2,18)12-5-4-9-8-20-13-7-10(15(17)19-3)6-11(12)14(9)13/h6-8,12,18H,4-5H2,1-3H3/t12-/m0/s1
InChIKey	RFNOCSRHGKIMNB-LBPRGKRZSA-N

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

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Trichocadinin L (CHEBI:214148) is a naphthoic acid (CHEBI:25483)

IUPAC Name
methyl (7S)-7-(2-hydroxypropan-2-yl)-2-oxatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraene-10-carboxylate

Manual Xrefs	Databases
98309182	ChemSpider