SpectraBase Compound ID | GQpI426829h |
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InChI | InChI=1S/C32H50O9/c1-21-13-18-27(36-6)26(35-5)12-10-9-11-19-39-31(33)23(3)32(38-8)30(37-7)29(22(2)28(21)41-32)40-20-24-14-16-25(34-4)17-15-24/h13-18,21-23,26-30H,9-12,19-20H2,1-8H3/b18-13+/t21-,22+,23+,26-,27+,28-,29-,30+,32+/m0/s1 |
InChIKey | UBBBHKGEVUHMRQ-XCMTYPJBSA-N |
Mol Weight | 578.7 g/mol |
Molecular Formula | C32H50O9 |
Exact Mass | 578.345483 g/mol |
SpectraBase Spectrum ID | LCkaE6s9fR5 |
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Name | 17-Desphenyl-5-O-(4'-methoxybenzyl)-3-O-methylsoraphen |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C32H50O9 |
InChI | InChI=1S/C32H50O9/c1-21-13-18-27(36-6)26(35-5)12-10-9-11-19-39-31(33)23(3)32(38-8)30(37-7)29(22(2)28(21)41-32)40-20-24-14-16-25(34-4)17-15-24/h13-18,21-23,26-30H,9-12,19-20H2,1-8H3/b18-13+/t21-,22+,23+,26-,27+,28-,29-,30+,32+/m0/s1 |
InChIKey | UBBBHKGEVUHMRQ-XCMTYPJBSA-N |
Molecular Weight | 578.743 g/mol |
SMILES | [C@@]12([C@@]([C@]([C@](C)([C@@](O2)([C@](\C=C\[C@]([C@@](OC)(CCCCCOC([C@]1(C)[H])=O)[H])(OC)[H])(C)[H])[H])[H])(OCc1ccc(cc1)OC)[H])(OC)[H])OC |
SPLASH | splash10-00di-0900000000-15dbc32f225bcd4524f8 |
Source of Spectrum | U-1995-812-20 |
Wiley ID | 766748 |