| SpectraBase Spectrum ID |
1GCRtaeCgUb |
| Name |
Mollamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H61N7O7S |
| InChI |
InChI=1S/C42H61N7O7S/c1-8-24(4)33-35(50)27-18-19-28(43-27)36(51)48-34(25(5)9-2)39(54)45-30(22-56-42(6,7)10-3)37(52)44-29(21-26-15-12-11-13-16-26)41(55)49-20-14-17-32(49)40-46-31(23-57-40)38(53)47-33/h10-13,15-16,24-25,27-34,43H,3,8-9,14,17-23H2,1-2,4-7H3,(H,44,52)(H,45,54)(H,47,53)(H,48,51)/t24-,25-,27?,28-,29-,30-,31-,32-,33-,34-/m0/s1 |
| InChIKey |
PGSIYTPXNKLUBT-JXUIEPSGSA-N |
| Molecular Weight |
808.052 g/mol |
| SMILES |
N1C([C@@](NC([C@@](NC(=O)[C@]2(NC(CC2)C([C@@](NC([C@]2(N=C([C@]3(N(C([C@@]1(Cc1ccccc1)[H])=O)CCC3)[H])SC2)[H])=O)([C@](CC)(C)[H])[H])=O)[H])([C@](CC)(C)[H])[H])=O)(COC(C=C)(C)C)[H])=O |
| SPLASH |
splash10-0079-1800000900-73cdeeb0231912150630 |
| Source of Spectrum |
B-47-61-0 |
| Synonyms |
(2S,8S,11S,14S,17S,22S,25R)-8-benzyl-14,22-bis[(2S)-butan-2-yl]-11-{[(2-methylbut-3-en-2-yl)oxy]methyl}-27-thia-6,9,12,15,23,28,29-heptaazatetracyclo[23.2.1.1(17,20).0(2,6)]nonacos-1(28)-ene-7,10,13,16,21,24-hexone |
| Wiley ID |
1417258 |
