SpectraBase Compound ID | KVSh7s6oKir |
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InChI | InChI=1S/C39H42O14/c1-15-7-8-49-25(40)5-6-26(41)50-13-17-18-11-23-34(3,19-9-22(19)37(23,47)14-51-30(15)42)24-12-36(46)21-10-20(21)35(4)29(36)28(38(18,24)52-32(17)44)27-16(2)31(43)53-39(27,48)33(35)45/h7,19-24,33,45-48H,5-6,8-14H2,1-4H3/b15-7+/t19-,20-,21+,22+,23-,24+,33-,34+,35+,36+,37+,38+,39+/m1/s1 |
InChIKey | VAOZXVGMCZGLOH-BQPKVCGRSA-N |
Mol Weight | 734.8 g/mol |
Molecular Formula | C39H42O14 |
Exact Mass | 734.257456 g/mol |
SpectraBase Spectrum ID | JXVTPKlSZQ3 |
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Name | CHLORAMULTILIDE_C |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C39H42O14 |
InChI | InChI=1S/C39H42O14/c1-15-7-8-49-25(40)5-6-26(41)50-13-17-18-11-23-34(3,19-9-22(19)37(23,47)14-51-30(15)42)24-12-36(46)21-10-20(21)35(4)29(36)28(38(18,24)52-32(17)44)27-16(2)31(43)53-39(27,48)33(35)45/h7,19-24,33,45-48H,5-6,8-14H2,1-4H3/b15-7+/t19-,20-,21+,22+,23-,24+,33-,34+,35+,36+,37+,38+,39+/m1/s1 |
InChIKey | VAOZXVGMCZGLOH-BQPKVCGRSA-N |
Literature Reference Author | M.J.XU,C.P.TANG,C.Q.KE,J.B.ZHANG,H.C.WEISS,E.R.GESING,Y.YE |
Literature Reference Citation | J.NAT.PROD.,70,1987(2007) |
Literature Reference DOI | 10.1021/np070433g |
Molecular Weight | 734.754 g/mol |
Sample ID | 31226 |
Solvent | C5D5N |