17,17-Dichloro-3-acetoxy-16(E)-chloromethyleneandrost-5-ene

SpectraBase Compound ID	HfBgiMGNJ9g
InChI	InChI=1S/C22H29Cl3O2/c1-13(26)27-16-6-8-20(2)14(10-16)4-5-17-18(20)7-9-21(3)19(17)11-15(12-23)22(21,24)25/h4,12,16-19H,5-11H2,1-3H3/b15-12+/t16-,17+,18-,19-,20-,21-/m0/s1
InChIKey	UFCRLGGTDMHSEZ-KQWODIDMSA-N Google Search
Mol Weight	431.83 g/mol
Molecular Formula	C22H29Cl3O2
Exact Mass	430.123313 g/mol

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SpectraBase Spectrum ID	D195HvwiMB4
Name	17,17-Dichloro-3-acetoxy-16(E)-chloromethyleneandrost-5-ene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H29Cl3O2
InChI	InChI=1S/C22H29Cl3O2/c1-13(26)27-16-6-8-20(2)14(10-16)4-5-17-18(20)7-9-21(3)19(17)11-15(12-23)22(21,24)25/h4,12,16-19H,5-11H2,1-3H3/b15-12+/t16-,17+,18-,19-,20-,21-/m0/s1
InChIKey	UFCRLGGTDMHSEZ-KQWODIDMSA-N
Molecular Weight	431.831 g/mol
SMILES	C1([C@@]2([C@@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])([H])C\C1=C\Cl)C)(Cl)Cl
SPLASH	splash10-00di-0009000000-46cdc92bbfede5e95ce5
Source of Spectrum	Y1-38-281-6
Synonyms	(3beta)-17,17-dichloro-1-(chloromethylene)androst-5-en-3-yl acetate 3.beta.-Acetoxy-17,17-dichloro-1(E)-chloromethyleneandrost-5-ene 3.beta.-Acetoxy-17,17-dichloro-16(E)-chloromethyleneandrost-5-ene Acetic acid [(3S,8R,9S,10R,13S,14S,16E)-17,17-dichloro-16-(chloromethylidene)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [(3S,8R,9S,10R,13S,14S,16E)-17,17-dichloro-16-(chloromethylidene)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8R,9S,10R,13S,14S,16E)-17,17-dichloro-16-(chloromethylene)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [(3S,8R,9S,10R,13S,14S,16E)-17,17-bis(chloranyl)-16-(chloranylmethylidene)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate
Wiley ID	1527598