Terminology Service for NFDI4Health
JSON

12-methyl-5-dehydroacetylhorminone

Go to external page http://purl.obolibrary.org/obo/CHEBI_66365

An abietane diterpenoid that is the acetate ester of 12-methyl-5-dehydrohorminone. Isolated from the roots of Salvia multicaulis, it exhibits antitubercular activity.

Term info

Label

12-methyl-5-dehydroacetylhorminone

Synonyms
  • (7alpha)-12-methoxy-11,14-dioxoabieta-5,8,12-trien-7-yl acetate
database cross reference
Subsets

3_STAR

IUPAC NAME
(7alpha)-12-methoxy-11,14-dioxoabieta-5,8,12-trien-7-yl acetate [ IUPAC ]

charge

0

formula

C23H30O5

has obo namespace

chebi_ontology

has related synonym

[(4aS,9R)-6-methoxy-1,1,4a-trimethyl-5,8-dioxo-7-propan-2-yl-2,3,4,9-tetrahydrophenanthren-9-yl] acetate

id

CHEBI:66365

inchi

InChI=1S/C23H30O5/c1-12(2)16-19(25)17-14(28-13(3)24)11-15-22(4,5)9-8-10-23(15,6)18(17)20(26)21(16)27-7/h11-12,14H,8-10H2,1-7H3/t14-,23+/m1/s1

inchikey

KRHKKRFFQDNBIN-FATZIPQQSA-N

mass

386.48130

monoisotopicmass

386.20932

smiles

COC1=C(C(C)C)C(=O)C2=C(C1=O)[C@@]1(C)CCCC(C)(C)C1=C[C@H]2OC(C)=O