| SpectraBase Spectrum ID |
4qWnaSwy4SE |
| Name |
Diacetate of Repandin B |
| CAS Registry Number |
71138-43-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H38O12 |
| InChI |
InChI=1S/C30H38O12/c1-9-15(3)27(33)40-24-21(30(36)37-8)13-11-12-16(4)23(39-19(7)32)25-22(17(5)28(34)41-25)26(24)42-29(35)20(10-2)14-38-18(6)31/h10,13,15,22-26H,4-5,9,11-12,14H2,1-3,6-8H3/b20-10+,21-13+ |
| InChIKey |
ZRGYUWPOZKHEDK-OYNCKMKSSA-N |
| Molecular Weight |
590.622 g/mol |
| SMILES |
C12C(OC(C2=C)=O)C(C(=C)CC\C=C/(C(C1OC(\C(COC(=O)C)=C\C)=O)OC(=O)C(CC)C)C(=O)OC)OC(=O)C |
| SPLASH |
splash10-0006-9000000000-56697659e751fd2ca3ca |
| Source of Spectrum |
J-44-3404-0 |
| Synonyms |
Methyl 11-(acetyloxy)-4-({(2E)-2-[(acetyloxy)methyl]-2-butenoyl}oxy)-5-[(2-methylbutanoyl)oxy]-3,10-dimethylene-2-oxo-2,3,3a,4,5,8,9,10,11,11a-decahydrocyclodeca[b]furan-6-carboxylate |
| Wiley ID |
1409324 |
