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Jurubidin
SpectraBase Compound ID 9pcDfSypyj0
InChI InChI=1S/C27H45NO2/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24H,5-15,28H2,1-4H3
InChIKey BADUKLRFTFBRSD-UHFFFAOYSA-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 Ph5fAWEhU
Name Spirostan-3-amine, (3.beta.,5.alpha.,25S)-
CAS Registry Number 6084-44-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H45NO2
InChI InChI=1S/C27H45NO2/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24H,5-15,28H2,1-4H3
InChIKey BADUKLRFTFBRSD-UHFFFAOYSA-N
Molecular Weight 415.662 g/mol
SMILES NC1CC2C(C3C(C4C(C5C(C)C6(OC5C4)CCC(CO6)C)(C)CC3)CC2)(C)CC1
SPLASH splash10-0a4l-9611000000-794054a90f26913c875a
Source of Spectrum CD-269-0-0
Synonyms Spirostan-3-amine 5.alpha.-Spirostan-3.beta.-amine, (25S)- Jurubidine Spirostan-3-amine, (3beta,5alpha,25S)- Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran], spirostan-3-amine deriv.
Wiley ID 1376086