| SpectraBase Spectrum ID |
LDw8RO7GuZj |
| Name |
11,12-deoxystecholide A acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H40O11 |
| InChI |
InChI=1S/C30H40O11/c1-9-10-24(34)39-22-14-20(36-17(4)31)16(3)13-23-30(29(8,41-30)27(35)40-23)26(38-19(6)33)25-15(2)11-12-21(28(22,25)7)37-18(5)32/h11,13,20-23,25-26H,9-10,12,14H2,1-8H3/b16-13-/t20-,21+,22+,23+,25+,26+,28-,29+,30+/m1/s1 |
| InChIKey |
FULVJJOPFOVSKE-AEHYJBMKSA-N |
| Molecular Weight |
576.639 g/mol |
| SMILES |
[C@@]123[C@@](C(=O)O[C@]3(\C=C/([C@@](C[C@@]([C@@]3([C@]([C@@]1(OC(=O)C)[H])(C(=CC[C@@]3(OC(=O)C)[H])C)[H])C)(OC(=O)CCC)[H])(OC(=O)C)[H])C)[H])(C)O2 |
| SPLASH |
splash10-004i-0000910000-5796611ac9e920e4d72c |
| Source of Spectrum |
J-57-1215-10 |
| Synonyms |
(2aS,5R,7S,7aR,8S,11aR,12S,12aS,13aR)-5,8,12-tris(acetyloxy)-4,7a,11,13a-tetramethyl-1-oxo-1,5,6,7,7a,8,9,11a,12,13a-decahydro-2aH-benzo[4,5]cyclodeca[1,2-b]oxireno[2,3-c]furan-7-yl butyrate |
| Wiley ID |
1408193 |
