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VERNOANTHELCIN-D;(5S,10S,11S,13R,16R,17S,20S,22R,23S,24S)-16,22-EPOXY-21,23-LACTONE-11,24-DIHYDROXY-STIGMASTA-8,14-DIEN-3,28-DIONE

View entire compound with spectra: 1 NMR

VERNOANTHELCIN-D;(5S,10S,11S,13R,16R,17S,20S,22R,23S,24S)-16,22-EPOXY-21,23-LACTONE-11,24-DIHYDROXY-STIGMASTA-8,14-DIEN-3,28-DIONE
SpectraBase Compound ID 4L7cSV6qMj4
InChI InChI=1S/C29H38O7/c1-13(2)29(34,14(3)30)25-24-21(26(33)36-25)23-20(35-24)11-18-17-7-6-15-10-16(31)8-9-27(15,4)22(17)19(32)12-28(18,23)5/h11,13,15,19-21,23-25,32,34H,6-10,12H2,1-5H3/t15-,19-,20-,21-,23+,24+,25-,27-,28?,29+/m0/s1
InChIKey PPVRVPDJLWAGFQ-CNQPXPPOSA-N
Mol Weight 498.6 g/mol
Molecular Formula C29H38O7
Exact Mass 498.261754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EveCjzVuyKQ
Name VERNOANTHELCIN-D;(5S,10S,11S,13R,16R,17S,20S,22R,23S,24S)-16,22-EPOXY-21,23-LACTONE-11,24-DIHYDROXY-STIGMASTA-8,14-DIEN-3,28-DIONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38O7
InChI InChI=1S/C29H38O7/c1-13(2)29(34,14(3)30)25-24-21(26(33)36-25)23-20(35-24)11-18-17-7-6-15-10-16(31)8-9-27(15,4)22(17)19(32)12-28(18,23)5/h11,13,15,19-21,23-25,32,34H,6-10,12H2,1-5H3/t15-,19-,20-,21-,23+,24+,25-,27-,28?,29+/m0/s1
InChIKey PPVRVPDJLWAGFQ-CNQPXPPOSA-N
Literature Reference Author L.HUA,W.Y.QI,S.H.HUSSAIN,K.GAO,M.ARFAN
Literature Reference Citation STEROIDS,77,811(2012)
Literature Reference DOI 10.1016/j.steroids.2012.03.003
Molecular Weight 498.617 g/mol
Sample ID 70622
Solvent CDCl3