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CANDPEIHATZBEA-CAQYPJOUSA-N

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CANDPEIHATZBEA-CAQYPJOUSA-N
SpectraBase Compound ID 2CaDzflyhFQ
InChI InChI=1S/C35H40O12/c1-19-17-25(45-31(40)23-13-9-7-10-14-23)28(39)34(18-42-20(2)36)30(44-22(4)38)27(46-32(41)24-15-11-8-12-16-24)26-29(43-21(3)37)35(19,34)47-33(26,5)6/h7-16,19,25-30,39H,17-18H2,1-6H3/t19-,25+,26-,27-,28+,29-,30-,34+,35-/m1/s1
InChIKey CANDPEIHATZBEA-CAQYPJOUSA-N
Mol Weight 652.7 g/mol
Molecular Formula C35H40O12
Exact Mass 652.251977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJIOdxCNFV5
Name CANDPEIHATZBEA-CAQYPJOUSA-N
Compound Number 15
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40O12
InChI InChI=1S/C35H40O12/c1-19-17-25(45-31(40)23-13-9-7-10-14-23)28(39)34(18-42-20(2)36)30(44-22(4)38)27(46-32(41)24-15-11-8-12-16-24)26-29(43-21(3)37)35(19,34)47-33(26,5)6/h7-16,19,25-30,39H,17-18H2,1-6H3/t19-,25+,26-,27-,28+,29-,30-,34+,35-/m1/s1
InChIKey CANDPEIHATZBEA-CAQYPJOUSA-N
Literature Reference Author J.HOHMANN,G.NAGY,Z.DINI,G.GUENTHER,I.PELCZER,G.JERKOVICH
Literature Reference Citation J.NAT.PROD.,58,1192(1995)
Literature Reference DOI 10.1021/np50122a006
Molecular Weight 652.695 g/mol
Solvent CDCl3
Source File Reference UWPR220