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dehydroabietic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_29571

An abietane diterpenoid that is abieta-8,11,13-triene substituted at position 18 by a carboxy group.

Term info

Label

dehydroabietic acid

Synonyms
  • Dehydroabietic acid
  • abieta-8,11,13-trien-18-oic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
abieta-8,11,13-trien-18-oic acid [ IUPAC ]

charge

0

formula

C20H28O2

has obo namespace

chebi_ontology

has related synonym

(-)-Dehydroabietic acid, 1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid, 13-Isopropylpodocarpa-8,11,13-trien-15-oic acid, Abieta-8,11,13-trien-18-oic acid, Dehydroabietate

id

CHEBI:29571

inchi

InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17-,19-,20-/m1/s1

inchikey

NFWKVWVWBFBAOV-MISYRCLQSA-N

mass

300.43510

monoisotopicmass

300.20893

smiles

[H][C@@]12CCc3cc(ccc3[C@@]1(C)CCC[C@@]2(C)C(O)=O)C(C)C