| SpectraBase Spectrum ID |
3r145d6gKBr |
| Name |
(3S,4R,7S,3'S,4'R,7'S)-7,7'-Methylenebis(7-benzyl-3,4,5-trimethyl-3H-isochromene-6,8(4H,7H)-dione) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H40O6 |
| InChI |
InChI=1S/C39H40O6/c1-22-26(5)44-19-30-32(22)24(3)34(40)38(36(30)42,17-28-13-9-7-10-14-28)21-39(18-29-15-11-8-12-16-29)35(41)25(4)33-23(2)27(6)45-20-31(33)37(39)43/h7-16,19-20,22-23,26-27H,17-18,21H2,1-6H3/t22-,23-,26-,27-,38-,39-/m0/s1 |
| InChIKey |
ZABFMNJNXWCHSA-KSGLQAFKSA-N |
| Molecular Weight |
604.743 g/mol |
| SMILES |
C([C@]1(C(C(=C2[C@]([C@@](OC=C2C1=O)(C)[H])(C)[H])C)=O)Cc1ccccc1)[C@]1(C(C(=C2[C@]([C@@](OC=C2C1=O)(C)[H])(C)[H])C)=O)Cc1ccccc1 |
| SPLASH |
splash10-05mp-4791100000-6de4cc85474992d8c25f |
| Source of Spectrum |
Chang-Lun Shao, et al. Bioorganic & Medicinal Chemistry Letters, V.21, 2011, P.690-693 |
| Synonyms |
(3S,3'S,4R,4'R,7S,7'S)-7,7'-methylenebis(7-benzyl-3,4,5-trimethyl-3,4-dihydro-6H-isochromene-6,8(7H)-dione) |
| Wiley ID |
1816829 |
