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N-(17-Androst-16-enoyl)-glycine
SpectraBase Compound ID 7WWqFVMKycy
InChI InChI=1S/C22H33NO3/c1-21-11-4-3-5-14(21)6-7-15-16-8-9-18(20(26)23-13-19(24)25)22(16,2)12-10-17(15)21/h9,14-17H,3-8,10-13H2,1-2H3,(H,23,26)(H,24,25)/t14?,15-,16-,17+,21-,22-/m0/s1
InChIKey XFHUTJRXIINPKX-KCAKVXIKSA-N
Mol Weight 359.5 g/mol
Molecular Formula C22H33NO3
Exact Mass 359.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Js30o0IuwfM
Name N-(17-Androst-16-enoyl)-glycine
Alternate Name(s) [((8R,9R,10S,13S,14S)-10,13-Dimethyl-2,3,4,5,6,7,8,9,10,11,12,13,14,15-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carbonyl)-amino]-acetic acid
Comments Less than 3 mono-isotopic peaks
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Formula C22H33NO3
InChI InChI=1S/C22H33NO3/c1-21-11-4-3-5-14(21)6-7-15-16-8-9-18(20(26)23-13-19(24)25)22(16,2)12-10-17(15)21/h9,14-17H,3-8,10-13H2,1-2H3,(H,23,26)(H,24,25)/t14?,15-,16-,17+,21-,22-/m0/s1
InChIKey XFHUTJRXIINPKX-KCAKVXIKSA-N
Molecular Weight 359.510 g/mol
SMILES N(C(C=1[C@@]2([C@]([C@@]3(CCC4[C@]([C@@]3(CC2)[H])(C)CCCC4)[H])(CC1)[H])C)=O)CC(=O)O
SPLASH splash10-000i-0090000000-0a93f8b3c6cf40b68540
Source of Spectrum F-65-4662-1b
Wiley ID 1680728