| SpectraBase Spectrum ID |
6IfcZB44tfz |
| Name |
Salignarine A |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H48N2O5 |
| InChI |
InChI=1S/C30H48N2O5/c1-9-16(2)27(35)31-25-23(34)15-29(6)22-12-13-28(5)20(17(3)32(7)8)10-11-21(28)19(22)14-24-30(29,37-24)26(25)36-18(4)33/h9,17,19-26,34H,10-15H2,1-8H3,(H,31,35)/b16-9+/t17-,19-,20+,21-,22-,23-,24-,25-,26-,28+,29+,30+/m0/s1 |
| InChIKey |
RRIHUBBCYOKLFC-XZELNKRSSA-N |
| Molecular Weight |
516.723 g/mol |
| SMILES |
N([C@]1([C@](C[C@]2([C@]3([C@]1(OC(=O)C)[H])[C@](C[C@]1([C@]4([C@](CC[C@]21[H])([C@](CC4)([C@@](N(C)C)(C)[H])[H])C)[H])[H])(O3)[H])C)(O)[H])[H])C(\C(=C\C)C)=O |
| SPLASH |
splash10-00di-9100110000-91668af2348d71cfa736 |
| Source of Spectrum |
G4-63-1367-1 |
| Synonyms |
(2S,3S,4S,4aR,5aS,6aS,6bS,9S,9aS,11aS,11bR)-9-[(1S)-1-(dimethylamino)ethyl]-2-hydroxy-9a,11b-dimethyl-3-{[(2E)-2-methyl-2-butenoyl]amino}hexadecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-4-yl acetate |
| Wiley ID |
1608640 |
