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N-[3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]ethanamide
SpectraBase Compound ID LT83OF1jYjW
InChI InChI=1S/C23H33NO3/c1-15(25)24-13-3-10-23(27)12-9-21-20-6-4-16-14-17(26)5-7-18(16)19(20)8-11-22(21,23)2/h5,7,14,19-21,26-27H,3-4,6,8-13H2,1-2H3,(H,24,25)/t19-,20-,21+,22+,23+/m1/s1
InChIKey KHLHPLUGCKYJEO-VROINQGHSA-N
Mol Weight 371.5 g/mol
Molecular Formula C23H33NO3
Exact Mass 371.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B16MAsL5Rdw
Name N-[3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]ethanamide
Alternate Name(s) N-[3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]acetamide
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Formula C23H33NO3
InChI InChI=1S/C23H33NO3/c1-15(25)24-13-3-10-23(27)12-9-21-20-6-4-16-14-17(26)5-7-18(16)19(20)8-11-22(21,23)2/h5,7,14,19-21,26-27H,3-4,6,8-13H2,1-2H3,(H,24,25)/t19-,20-,21+,22+,23+/m1/s1
InChIKey KHLHPLUGCKYJEO-VROINQGHSA-N
Molecular Weight 371.521 g/mol
SMILES Oc1ccc2c(CC[C@]3([C@]4([C@@]([C@](CCCNC(=O)C)(CC4)O)(CC[C@]23[H])C)[H])[H])c1
SPLASH splash10-0pb9-0079000000-a15b023353f856e626f5
Source of Spectrum E1-38-2347-19
Wiley ID 1598398