| SpectraBase Spectrum ID |
38ocZez49A |
| Name |
17-epi-acnistin A |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H38O6 |
| InChI |
InChI=1S/C28H38O6/c1-23-13-18(19(14-23)33-22(30)26(23,4)31)27(32)11-8-16-15-12-21-28(34-21)9-5-6-20(29)25(28,3)17(15)7-10-24(16,27)2/h5-6,15-19,21,31-32H,7-14H2,1-4H3/t15-,16-,17-,18-,19+,21+,23+,24-,25-,26-,27-,28+/m0/s1 |
| InChIKey |
RNORCGKHUAMBKR-MNJRBZCOSA-N |
| Molecular Weight |
470.606 g/mol |
| SMILES |
O[C@]1(C(O[C@]2([C@@]([C@@]3([C@@]4([C@]([C@@]5(C[C@@]6([C@]7([C@@]([C@]5(CC4)[H])(C(=O)C=CC7)C)O6)[H])[H])(CC3)[H])C)O)(C[C@]1(C)C2)[H])[H])=O)C |
| SPLASH |
splash10-0f9i-0690000000-1ec7c14d46a7a1f8fc01 |
| Source of Spectrum |
G4-63-513-1 |
| Synonyms |
(4aS,5aR,6aS,6bS,9S,9aS,11aS,11bR)-9-hydroxy-9-[(1R,4R,5R,7S)-4-hydroxy-4,5-dimethyl-3-oxo-2-oxabicyclo[3.2.1]oct-7-yl]-9a,11b-dimethyl-5a,6,6a,6b,7,8,9,9a,10,11,11a,11b-dodecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-1(4H)-one |
| Wiley ID |
1608356 |
