CHEBI:79861 - 6-(Dibromomethylene)-17beta-hydroxy-androst-4-en-3-one propionate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-(Dibromomethylene)-17beta-hydroxy-androst-4-en-3-one propionate
ChEBI ID CHEBI:79861
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C23H30Br2O3
Net Charge 0
Average Mass 514.29100
Monoisotopic Mass 512.05617
InChI InChI=1S/C23H30Br2O3/c1-4-20(27)28-19-6-5-16-14-12-15(21(24)25)18-11-13(26)7-9-22(18,2)17(14)8-10-23(16,19)3/h11,14,16-17,19H,4-10,12H2,1-3H3/t14-,16-,17-,19-,22+,23-/m0/s1
InChIKey ZVBFVKPTXOYOHX-WTBQFDOKSA-N
SMILES CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CC(=C(Br)Br)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing 6-(Dibromomethylene)-17beta-hydroxy-androst-4-en-3-one propionate (CHEBI:79861) is a steroid ester (CHEBI:47880)
Manual Xref Database
C15359 KEGG COMPOUND
View more database links