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Pregna-16,20-dien-15-ol, 3-[(tetrahydro-2H-pyran-2-yl)oxy]-, (3.beta.,5.beta.)-
SpectraBase Compound ID GJNus7b6Sl0
InChI InChI=1S/C26H40O3/c1-4-17-16-22(27)24-20-9-8-18-15-19(29-23-7-5-6-14-28-23)10-12-25(18,2)21(20)11-13-26(17,24)3/h4,16,18-24,27H,1,5-15H2,2-3H3/t18-,19+,20-,21+,22?,23?,24-,25+,26-/m1/s1
InChIKey LCHHRPBXAOJAMS-DKTVFFDFSA-N
Mol Weight 400.6 g/mol
Molecular Formula C26H40O3
Exact Mass 400.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4D4NVKtpvls
Name Pregna-16,20-dien-15-ol, 3-[(tetrahydro-2H-pyran-2-yl)oxy]-, (3.beta.,5.beta.)-
Alternate Name(s) (3beta,5beta)-3-(tetrahydro-2H-pyran-2-yloxy)pregna-16,20-dien-15-ol 5.beta.-pregna-16,20-diene-3.beta.,15.XI,-diol 3-(tetrahydropyran-2'-yl)ether
CAS Registry Number 89025-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O3
InChI InChI=1S/C26H40O3/c1-4-17-16-22(27)24-20-9-8-18-15-19(29-23-7-5-6-14-28-23)10-12-25(18,2)21(20)11-13-26(17,24)3/h4,16,18-24,27H,1,5-15H2,2-3H3/t18-,19+,20-,21+,22?,23?,24-,25+,26-/m1/s1
InChIKey LCHHRPBXAOJAMS-DKTVFFDFSA-N
Molecular Weight 400.603 g/mol
SMILES OC1[C@]2([C@@]3(CC[C@]4([C@@]([C@]3(CC[C@@]2(C(=C1)C=C)C)[H])(CC[C@](OC1OCCCC1)(C4)[H])C)[H])[H])[H]
SPLASH splash10-000j-9087000000-2b948a125a87442e6961
Source of Spectrum KC-1985-1603-20
Wiley ID 1369647