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17-hydroxyazadiradione

Go to external page http://purl.obolibrary.org/obo/CHEBI_67284

A limonoid that is azadiradione substituted by a hydroxy group at position 17. It has been isolated from Azadirachta indica.

Term info

Label

17-hydroxyazadiradione

Synonyms
  • (5alpha,7alpha,13alpha,17beta)-17-(furan-3-yl)-17-hydroxy-4,4,8-trimethyl-3,16-dioxoandrosta-1,14-dien-7-yl acetate
database cross reference
Subsets

3_STAR

IUPAC NAME
(5alpha,7alpha,13alpha,17beta)-17-(furan-3-yl)-17-hydroxy-4,4,8-trimethyl-3,16-dioxoandrosta-1,14-dien-7-yl acetate [ IUPAC ]

charge

0

formula

C28H34O6

has obo namespace

chebi_ontology

has related synonym

17beta-hydroxyazadiradione

id

CHEBI:67284

inchi

InChI=1S/C28H34O6/c1-16(29)34-23-14-19-24(2,3)21(30)8-10-25(19,4)18-7-11-26(5)20(27(18,23)6)13-22(31)28(26,32)17-9-12-33-15-17/h8-10,12-13,15,18-19,23,32H,7,11,14H2,1-6H3/t18-,19+,23-,25-,26-,27-,28+/m1/s1

inchikey

QXKHBVSTPRHRQV-CWUDDJIGSA-N

mass

466.56600

monoisotopicmass

466.23554

smiles

CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2CC[C@]3(C)C(=CC(=O)[C@@]3(O)c3ccoc3)[C@]12C