EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:91895 - 3-[2-(diethylamino)ethoxy]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one

Default Structure
ChEBI IDCHEBI:91895
ChEBI Name3-[2-(diethylamino)ethoxy]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
Stars
DownloadsMolfile
FormulaC25H41NO2
Net Charge0
Average Mass387.608
Monoisotopic Mass387.31373
SMILESCCN(CC)CCOC1CCC2(C)C(=CCC3C4CCC(=O)C4(C)CCC32)C1
InChIInChI=1S/C25H41NO2/c1-5-26(6-2)15-16-28-19-11-13-24(3)18(17-19)7-8-20-21-9-10-23(27)25(21,4)14-12-22(20)24/h7,19-22H,5-6,8-17H2,1-4H3
InChIKeyDMZCCFMMPHJWQY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[2-(diethylamino)ethoxy]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one (CHEBI:91895) is a androstanoid (CHEBI:50402)
Manual XrefsDatabases
LSM-1831LINCS