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OXANDRINE
SpectraBase Compound ID HOZucMujvEi
InChI InChI=1S/C37H38N2O7/c1-38-12-11-22-18-32(45-5)36(42)37-33(22)27(38)15-20-6-9-29(43-3)26(14-20)25-16-23(7-8-28(25)40)35(41)34-24-19-31(46-37)30(44-4)17-21(24)10-13-39(34)2/h6-9,14,16-19,27,34,40,42H,10-13,15H2,1-5H3/t27-,34+/m0/s1
InChIKey XCZPVAXCZZECDL-NDOVKIIASA-N
Mol Weight 622.7 g/mol
Molecular Formula C37H38N2O7
Exact Mass 622.267902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HpWm3NQYIxM
Name OXANDRINE
Compound Number 347
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H38N2O7
InChI InChI=1S/C37H38N2O7/c1-38-12-11-22-18-32(45-5)36(42)37-33(22)27(38)15-20-6-9-29(43-3)26(14-20)25-16-23(7-8-28(25)40)35(41)34-24-19-31(46-37)30(44-4)17-21(24)10-13-39(34)2/h6-9,14,16-19,27,34,40,42H,10-13,15H2,1-5H3/t27-,34+/m0/s1
InChIKey XCZPVAXCZZECDL-NDOVKIIASA-N
Literature Reference Author P.L.SCHIFF
Literature Reference Citation J.NAT.PROD.,54,645(1991)
Literature Reference DOI 10.1021/np50075a001
Molecular Weight 622.718 g/mol
Solvent CDCl3
Source File Reference UWPR2000