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Bis isopropylidiene of 3.beta.,20.beta.-diamino-18-hydroxy-5-pregnene
SpectraBase Compound ID CU4xT6RMQ13
InChI InChI=1S/C27H44N2O/c1-17(2)28-19(5)23-9-10-25-22-8-7-20-15-21(29-18(3)4)11-13-26(20,6)24(22)12-14-27(23,25)16-30/h7,19,21-25,30H,8-16H2,1-6H3/t19-,21-,22+,23?,24-,25-,26-,27-/m0/s1
InChIKey ILYBOPOBNOYYIH-CKGDPLDPSA-N
Mol Weight 412.7 g/mol
Molecular Formula C27H44N2O
Exact Mass 412.345364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cQzTS4bDd6
Name Bis isopropylidiene of 3.beta.,20.beta.-diamino-18-hydroxy-5-pregnene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44N2O
InChI InChI=1S/C27H44N2O/c1-17(2)28-19(5)23-9-10-25-22-8-7-20-15-21(29-18(3)4)11-13-26(20,6)24(22)12-14-27(23,25)16-30/h7,19,21-25,30H,8-16H2,1-6H3/t19-,21-,22+,23?,24-,25-,26-,27-/m0/s1
InChIKey ILYBOPOBNOYYIH-CKGDPLDPSA-N
Molecular Weight 412.662 g/mol
SMILES OC[C@]12[C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](N=C(C)C)(C4)[H])C)[H])(CCC1[C@@](N=C(C)C)(C)[H])[H]
SPLASH splash10-000b-9123000000-6f46d272e62ba890594f
Source of Spectrum PL-1982-0-0
Synonyms (3beta,20S)-3,20-bis[(1-methylethylidene)amino]pregn-5-en-18-ol
Wiley ID 1374672