EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:4532 - diethylstilbestrol diphosphate

ChEBI IDCHEBI:4532
ChEBI Namediethylstilbestrol diphosphate
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC18H22O8P2
Net Charge0
Average Mass428.314
Monoisotopic Mass428.07899
SMILESCC/C(=C(/CC)c1ccc(OP(=O)(O)O)cc1)c1ccc(OP(=O)(O)O)cc1
InChIInChI=1S/C18H22O8P2/c1-3-17(13-5-9-15(10-6-13)25-27(19,20)21)18(4-2)14-7-11-16(12-8-14)26-28(22,23)24/h5-12H,3-4H2,1-2H3,(H2,19,20,21)(H2,22,23,24)/b18-17+
InChIKeyNLORYLAYLIXTID-ISLYRVAYSA-N
ChEBI Ontology
Outgoing Relation(s)
diethylstilbestrol diphosphate (CHEBI:4532) has functional parent diethylstilbestrol (CHEBI:41922)
diethylstilbestrol diphosphate (CHEBI:4532) is a aryl phosphate (CHEBI:36943)
Synonyms  Source
Diethylstilbestrol diphosphateKEGG COMPOUND
FosfestrolKEGG COMPOUND
Diethylstilbestrol bisphosphateKEGG COMPOUND
diethylstilbesterol diphosphateDrugCentral
diethylstilbestryl diphosphateDrugCentral
stilbestrol diphosphateDrugCentral
Manual XrefsDatabases
C08145KEGG COMPOUND
D00946KEGG DRUG
3248DrugCentral
Registry NumbersSources
CAS:522-40-7KEGG COMPOUND