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6.beta.-methoxy-3.alpha.,5.alpha.-cyclobisnorcholane-21,22-diol
SpectraBase Compound ID 7m2xT18idKP
InChI InChI=1S/C23H38O3/c1-21-8-7-19-16(18(21)5-4-17(21)14(12-24)13-25)10-20(26-3)23-11-15(23)6-9-22(19,23)2/h14-20,24-25H,4-13H2,1-3H3/t15-,16?,17?,18?,19?,20-,21?,22?,23+/m1/s1
InChIKey YCTLHPOOQLKNIR-VLTLGGMKSA-N
Mol Weight 362.6 g/mol
Molecular Formula C23H38O3
Exact Mass 362.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ZUbI5CO4db
Name 6.beta.-methoxy-3.alpha.,5.alpha.-cyclobisnorcholane-21,22-diol
CAS Registry Number 119005-03-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H38O3
InChI InChI=1S/C23H38O3/c1-21-8-7-19-16(18(21)5-4-17(21)14(12-24)13-25)10-20(26-3)23-11-15(23)6-9-22(19,23)2/h14-20,24-25H,4-13H2,1-3H3/t15-,16?,17?,18?,19?,20-,21?,22?,23+/m1/s1
InChIKey YCTLHPOOQLKNIR-VLTLGGMKSA-N
Molecular Weight 362.554 g/mol
SMILES OCC(CO)C1C2(C(C3C[C@]([C@]45C(C3CC2)(CC[C@]5([H])C4)C)(OC)[H])CC1)C
SPLASH splash10-0bu1-0009000000-eafa5b539deb67808847
Source of Spectrum J-55-3491-21
Synonyms 2-[(5R,7R,8R)-8-methoxy-2,15-dimethylpentacyclo[8.7.0.0(2,7).0(5,7).0(11,15)]heptadecan-14-yl]propane-1,3-diol
Wiley ID 1349982