Apotrichothecene (CHEBI:173715)

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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	Apotrichothecene

ChEBI ID	CHEBI:173715

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O2

Net Charge

Average Mass

236.355

Monoisotopic Mass

236.17763

InChI

InChI=1S/C15H24O2/c1-11-5-8-13(2)12(9-11)17-15(10-16)7-4-6-14(13,15)3/h9,12,16H,4-8,10H2,1-3H3

InChIKey

JFZZTCKYMWJCGK-UHFFFAOYSA-N

SMILES

O1C2(C(C3(C1C=C(CC3)C)C)(CCC2)C)CO

ChEBI Ontology
Outgoing	Apotrichothecene (CHEBI:173715) is a oxolanes (CHEBI:26912)

IUPAC Name

(6,8a,8b-trimethyl-1,2,3,4a,7,8-hexahydrocyclopenta[b][1]benzouran-3a-yl)methanol