erinacol (CHEBI:194345)

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CHEBI:194345 - erinacol

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ChEBI ID	CHEBI:194345
ChEBI Name	erinacol
Stars
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C20H32O
Net Charge	0
Average Mass	288.475
Monoisotopic Mass	288.24532
SMILES	[H][C@]12CCC(C)=C[C@H](O)[C@]1(C)CC[C@@]1(C)CCC(C(C)C)=C12
InChI	InChI=1S/C20H32O/c1-13(2)15-8-9-19(4)10-11-20(5)16(18(15)19)7-6-14(3)12-17(20)21/h12-13,16-17,21H,6-11H2,1-5H3/t16-,17+,19-,20-/m1/s1
InChIKey	ZTGGPQBJLZKPHO-PIKOESSRSA-N

ChEBI Ontology

Outgoing Relation(s)
	erinacol (CHEBI:194345) is a carbotricyclic compound (CHEBI:38032)
	erinacol (CHEBI:194345) is a diterpene (CHEBI:35190)
	erinacol (CHEBI:194345) is a polycyclic olefin (CHEBI:35714)

UniProt Name	Source
erinacol	UniProt

Manual Xrefs	Databases
CPD-26037	MetaCyc

Citations