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20-(5-Methyl-2-piperidinyl)pregn-5-ene-3,16-diol
SpectraBase Compound ID K730vHBfWuA
InChI InChI=1S/C27H45NO2/c1-16-5-8-23(28-15-16)17(2)25-24(30)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,28-30H,5,7-15H2,1-4H3/t16-,17?,19?,20?,21?,22?,23+,24?,25?,26?,27?/m1/s1
InChIKey IRRHFODGOMSPEE-ZGLVCVNXSA-N
Mol Weight 415.7 g/mol
Molecular Formula C27H45NO2
Exact Mass 415.34503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lpwOomX0Cf
Name 20-(5-Methyl-2-piperidinyl)pregn-5-ene-3,16-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45NO2
InChI InChI=1S/C27H45NO2/c1-16-5-8-23(28-15-16)17(2)25-24(30)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,28-30H,5,7-15H2,1-4H3/t16-,17?,19?,20?,21?,22?,23+,24?,25?,26?,27?/m1/s1
InChIKey IRRHFODGOMSPEE-ZGLVCVNXSA-N
Molecular Weight 415.662 g/mol
SMILES N1C[C@@](CC[C@]1(C(C1C2(C(CC1O)C1C(CC2)C2(C(=CC1)CC(CC2)O)C)C)C)[H])(C)[H]
SPLASH splash10-0002-9200000000-5cdf9bf7d3fda38229db
Source of Spectrum NP-14-7819-0
Synonyms 16-Epi-dihydro-solasodine Dihydro-pseudosolasodine 10,13-dimethyl-17-[1-(5-methyl-2-piperidinyl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol 10,13-dimethyl-17-[1-(5-methylpiperidin-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
Wiley ID 1111992