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19-NOR-16-ALPHA-ACETOXY-10-BETA-HYDROXYASCLEPIN
SpectraBase Compound ID 1DRHE6KKdn7
InChI InChI=1S/C32H44O12/c1-15-9-25(42-17(3)34)32(38)28(40-15)43-22-11-19-5-6-21-20(30(19,36)12-23(22)44-32)7-8-29(4)27(18-10-26(35)39-14-18)24(41-16(2)33)13-31(21,29)37/h10,15,19-25,27-28,36-38H,5-9,11-14H2,1-4H3/t15-,19?,20?,21?,22-,23-,24-,25+,27+,28+,29-,30-,31+,32+/m1/s1
InChIKey GTDWVHHOYGPTHH-AJMXGNBHSA-N
Mol Weight 620.7 g/mol
Molecular Formula C32H44O12
Exact Mass 620.283277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID INLEAicMr7N
Name 19-NOR-16-ALPHA-ACETOXY-10-BETA-HYDROXYASCLEPIN
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H44O12
InChI InChI=1S/C32H44O12/c1-15-9-25(42-17(3)34)32(38)28(40-15)43-22-11-19-5-6-21-20(30(19,36)12-23(22)44-32)7-8-29(4)27(18-10-26(35)39-14-18)24(41-16(2)33)13-31(21,29)37/h10,15,19-25,27-28,36-38H,5-9,11-14H2,1-4H3/t15-,19?,20?,21?,22-,23-,24-,25+,27+,28+,29-,30-,31+,32+/m1/s1
InChIKey GTDWVHHOYGPTHH-AJMXGNBHSA-N
Literature Reference Author M.C.ROY,F.R.CHANG,H.C.HUANG,M.Y.N.CHIANG,Y.C.WU
Literature Reference Citation J.NAT.PROD.,68,1494(2005)
Literature Reference DOI 10.1021/np0501740
Molecular Weight 620.694 g/mol
Solvent CDCl3
Source File Reference UWMZ13210