(10S)-12,16-epoxy-17(15->16)-abeo-3,5,8,12,15-abietapentaen-2,7,11,14-tetraone (CHEBI:220069)

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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	(10S)-12,16-epoxy-17(15->16)-abeo-3,5,8,12,15-abietapentaen-2,7,11,14-tetraone

ChEBI ID	CHEBI:220069

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H16O5

Net Charge

Average Mass

336.343

Monoisotopic Mass

336.09977

InChI

InChI=1S/C20H16O5/c1-8-5-11-17(23)15-13(21)6-12-9(2)10(3)14(22)7-20(12,4)16(15)18(24)19(11)25-8/h5-6H,7H2,1-4H3/t20-/m0/s1

InChIKey

BCQASUIJKLATHD-FQEVSTJZSA-N

SMILES

O=C1C2=C(C(=O)C3=C1OC(C)=C3)C(=O)C=C4[C@@]2(CC(=O)C(=C4C)C)C

Metabolite of Species	Details
Pestalotiopsis adusta (NCBI:txid173179)	See: DOI

ChEBI Ontology
Outgoing	(10S)-12,16-epoxy-17(15->16)-abeo-3,5,8,12,15-abietapentaen-2,7,11,14-tetraone (CHEBI:220069) is a abietane diterpenoid (CHEBI:36762)

IUPAC Name

(11bS)-3,4,9,11b-tetramethyl-1H-naphtho[2,1-][1]benzouran-2,6,7,11-tetrone