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3.alpha.-(Succinyloxy)-23-{1'-[(2"-dimethylamino)ethyl]benzimidazol-2'-yl}nor-cholane
SpectraBase Compound ID EFf2ZNpDMD6
InChI InChI=1S/C38H57N3O4/c1-25(10-15-34-39-32-8-6-7-9-33(32)41(34)23-22-40(4)5)29-13-14-30-28-12-11-26-24-27(45-36(44)17-16-35(42)43)18-20-37(26,2)31(28)19-21-38(29,30)3/h6-9,25-31H,10-24H2,1-5H3,(H,42,43)/t25?,26?,27-,28?,29?,30?,31?,37?,38?/m1/s1
InChIKey TWMQVLZPJXMDNZ-YWWQLQBSSA-N
Mol Weight 619.9 g/mol
Molecular Formula C38H57N3O4
Exact Mass 619.434907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0fAlBMBzWG
Name 3.alpha.-(Succinyloxy)-23-{1'-[(2"-dimethylamino)ethyl]benzimidazol-2'-yl}nor-cholane
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Formula C38H57N3O4
InChI InChI=1S/C38H57N3O4/c1-25(10-15-34-39-32-8-6-7-9-33(32)41(34)23-22-40(4)5)29-13-14-30-28-12-11-26-24-27(45-36(44)17-16-35(42)43)18-20-37(26,2)31(28)19-21-38(29,30)3/h6-9,25-31H,10-24H2,1-5H3,(H,42,43)/t25?,26?,27-,28?,29?,30?,31?,37?,38?/m1/s1
InChIKey TWMQVLZPJXMDNZ-YWWQLQBSSA-N
Molecular Weight 619.891 g/mol
SMILES OC(CCC(O[C@]1(CC2CCC3C(C2(CC1)C)CCC1(C(C(CCc2[n](c4c(cccc4)n2)CCN(C)C)C)CCC31)C)[H])=O)=O
SPLASH splash10-0ab9-9300000000-d1b992fa35f765015f93
Source of Spectrum G-60-268-0
Wiley ID 748931