1,4-dihydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphthalene-1-carboxylic acid (CHEBI:182491)

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ChEBI Name	1,4-dihydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphthalene-1-carboxylic acid

ChEBI ID	CHEBI:182491

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O5

Net Charge

Average Mass

284.352

Monoisotopic Mass

284.16237

InChI

InChI=1S/C15H24O5/c1-13(2)5-4-6-14(3)11(13)10(17)7-9(8-16)15(14,20)12(18)19/h7,10-11,16-17,20H,4-6,8H2,1-3H3,(H,18,19)

InChIKey

LZNVQLZWBFBDBG-UHFFFAOYSA-N

SMILES

OC1(C2(C(C(CCC2)(C)C)C(O)C=C1CO)C)C(O)=O

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	1,4-dihydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphthalene-1-carboxylic acid (CHEBI:182491) is a hydroxy monocarboxylic acid (CHEBI:35868)

IUPAC Name

1,4-dihydroxy-2-(hydroxymethyl)-5,5,8a-trimethyl-4a,6,7,8-tetrahydro-4H-naphthalene-1-carboxylic acid