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Sophoradiol
SpectraBase Compound ID CyMMdNfCBfu
InChI InChI=1S/C30H50O2/c1-25(2)17-20-19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-30(22,8)29(19,7)16-15-27(20,5)24(32)18-25/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21?,22?,23-,24+,27+,28-,29+,30+/m0/s1
InChIKey ZEGUWBQDYDXBNS-HZIFPBLRSA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fGX9qcXPWh
Name SOPHORADIOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-25(2)17-20-19-9-10-22-28(6)13-12-23(31)26(3,4)21(28)11-14-30(22,8)29(19,7)16-15-27(20,5)24(32)18-25/h9,20-24,31-32H,10-18H2,1-8H3/t20-,21?,22?,23-,24+,27+,28-,29+,30+/m0/s1
InChIKey ZEGUWBQDYDXBNS-HZIFPBLRSA-N
Literature Reference Author J.-E.KINJO,T.TAKESHITA,Y.ABE,N.TERADA,H.YAMASHITA,M.YAMASAKI ,K.TAKEUCHI,K.MURAKA
Literature Reference Citation CHEM.PHARM.BULL.,36,1174(1988)
Literature Reference DOI 10.1248/cpb.36.1174
Molecular Weight 442.726 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK46