4-(((3aS,4S,5S,6R,7R,7aR)-6-(bis(4-methoxyphenyl)(phenyl)methoxy)-1,3-dioxo-2-phenyloctahydro-1H-4,7-epoxyisoindol-5-yl)oxy)-4-oxobutanoic acid
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Basic information
| GHS | |
|---|---|
| Exact Mass | 677.22610 |
| Smiles | COC1C=CC(C(C2C=CC(OC)=CC=2)(C2C=CC=CC=2)O[C@@H]2[C@@H]3O[C@@H]([C@@H]4[C@H]3C(=O)N(C3C=CC=CC=3)C4=O)[C@@H]2OC(=O)CCC(O)=O)=CC=1 |
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| Canonical Smiles | COC1C=CC(=CC=1)C(O[C@H]1[C@@H](OC(=O)CCC(O)=O)[C@H]2O[C@@H]1[C@H]1[C@@H]2C(=O)N(C2C=CC=CC=2)C1=O)(C1C=CC(=CC=1)OC)C1C=CC=CC=1 |
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| Inchi | InChI=1S/C39H35NO10/c1-46-27-17-13-24(14-18-27)39(23-9-5-3-6-10-23,25-15-19-28(47-2)20-16-25)50-36-34-32-31(33(49-34)35(36)48-30(43)22-21-29(41)42)37(44)40(38(32)45)26-11-7-4-8-12-26/h3-20,31-36H,21-22H2,1-2H3,(H,41,42)/t31-,32+,33-,34+,35-,36+/m0/s1 |
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| InchiKey | KPROLRFVRRGFBD-RHEFJYAGSA-N |
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