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estra-1,5(10)-diene-3,4,17-trione

Go to external page http://purl.obolibrary.org/obo/CHEBI_87263

An o-quinone resulting from the formal oxidation of the dihydroxyphenyl moiety of 4-hydroxyestrone.

Term info

Label

estra-1,5(10)-diene-3,4,17-trione

Synonyms
  • estra-1,5(10)-diene-3,4,17-trione
database cross reference
Subsets

3_STAR

IUPAC NAME
estra-1,5(10)-diene-3,4,17-trione [ IUPAC ]

charge

0

formula

C18H20O3

has obo namespace

chebi_ontology

has related synonym

3,4-estrone o-quinone, 1,5(10)estradiene-3,14,17-trione, 3,4-estrone quinone, 3,4-estrogen o-quinone, 3,4-estrone ortho-quinone, 3,4-estronequinone, estrone-3,4-quinone

id

CHEBI:87263

inchi

InChI=1S/C18H20O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14H,2-3,5,7-9H2,1H3/t11-,12-,14+,18+/m1/s1

inchikey

REMSDZFYMQQJFD-QDTBLXIISA-N

mass

284.34960

monoisotopicmass

284.14124

smiles

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(=O)C4=O)[C@@H]1CCC2=O