代马孕酮(15262-77-8)名称与标识符
名称
英文别名:
Pregna-1,4,6-triene-3,20-dione,6-chloro-17-hydroxy-;Delmadinone;(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-17-hydroxy-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one;Δ1-ChlorMadinone;6-Chloro-17-hydroxypregna-1,4,6-triene-3,20-dione;
标识符
InChIKey:
ZSAMZEYLGUEVJW-TTYLFXKOSA-N
Inchi:
InChI=1S/C21H25ClO3/c1-12(23)21(25)9-6-16-14-11-18(22)17-10-13(24)4-7-19(17,2)15(14)5-8-20(16,21)3/h4,7,10-11,14-16,25H,5-6,8-9H2,1-3H3/t14-,15+,16+,19-,20+,21+/m1/s1
SMILES:
ClC1C2=CC(C=C[C@]2(C)[C@@]2([H])CC[C@]3(C)[C@@](C(C)=O)(CC[C@@]3([H])[C@]2([H])C=1)O)=O