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5-ALPHA,8-ALPHA-EPIDIOXY-(22E,24R)-23-METHYLERGOSTA-6,22-DIEN-3-BETA-OL
SpectraBase Compound ID I84xAEgZuW2
InChI InChI=1S/C29H46O3/c1-18(2)21(5)19(3)16-20(4)23-8-9-24-26(23,6)12-11-25-27(7)13-10-22(30)17-28(27)14-15-29(24,25)32-31-28/h14-16,18,20-25,30H,8-13,17H2,1-7H3/b19-16+/t20-,21+,22+,23-,24-,25-,26-,27-,28-,29+/m1/s1
InChIKey BEFYGZGLHDYVIF-XJDWZFEKSA-N
Mol Weight 442.7 g/mol
Molecular Formula C29H46O3
Exact Mass 442.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1gC1m6HqnE
Name 5-ALPHA,8-ALPHA-EPIDIOXY-(22E,24R)-23-METHYLERGOSTA-6,22-DIEN-3-BETA-OL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H46O3
InChI InChI=1S/C29H46O3/c1-18(2)21(5)19(3)16-20(4)23-8-9-24-26(23,6)12-11-25-27(7)13-10-22(30)17-28(27)14-15-29(24,25)32-31-28/h14-16,18,20-25,30H,8-13,17H2,1-7H3/b19-16+/t20-,21+,22+,23-,24-,25-,26-,27-,28-,29+/m1/s1
InChIKey BEFYGZGLHDYVIF-XJDWZFEKSA-N
Literature Reference Author Y.YAOITA,K.ANEMIYA,H.OHNUMA,K.FURUMURA,A.MASAKI,T.MATSUKI,M. KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,46,944(1998)
Literature Reference DOI 10.1248/cpb.46.944
Molecular Weight 442.682 g/mol
Solvent C6D6
Source File Reference UWMS6472