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«[3,2-/c]Pyrazole-androst-4-en-17β-ol»
CSA Names: [3,2-c]Pyrazole-androst-4-en-17β-ol
CSA Location: Schedule III Section (f) Subsection (1.0)(88)
CSA History: H.R. 4771, 113 Cong., 2nd Sess. added effective 18 Dec 2014
Names: (17β)-1H-Pyrazolo[3ʹ,4ʹ:4,3]androst-4-en-17-ol (other)
(1S,3aS,3bR,10aR,10bS,12aS)-10a,12a-Dimethyl-1,2,3,3a,3b,4,5,8,10,10a,10b,11,12,12a-tetradecahydrocyclopenta[5,6]naphtho[1,2-f]indazol-1-ol (IUPAC)
Molecular formula: C20H28N2O
Nominal mass: 312
Average mass: 312.4491
Monoisotopic mass: 312.220164
CAS registry number:
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Standard InChI: InChI=1S/C20H28N2O/c1-19-8-7-16-14(15(19)5-6-18(19)23)4-3-13-9-17-12(11-21-22-17)10-20(13,16)2/h9,11,14-16,18,23H,3-8,10H2,1-2H3,(H,21,22)/t14-,15-,16-,18-,19-,20-/m0/s1
Standard InChI key: TZVXVVYNTVBMQS-GJCUDGATSA-N
SMILES: O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=Cc3c(C[C@]12C)c[nH]n3
Tags: USCSA,H.R.4771,recent
 
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