| SpectraBase Spectrum ID |
7ln0EiUnGSz |
| Name |
(2S*,3R*,5aS*,13aR*,12aS*,6aR*,7Z,10S*,11R*)-3-[(4-Bromobenzoyl)oxy]-2,11-divinyl-10-hydroxy-2,3,4,5,5a,6a,10,11,12a,13,13a-dodecahydro-1,6,12-trioxacyclohepta[4,5]benzo[1,2]cyclooctene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H29BrO6 |
| InChI |
InChI=1S/C25H29BrO6/c1-3-18-13-17(27)9-10-21-23(29-18)14-24-22(31-21)12-11-20(19(4-2)30-24)32-25(28)15-5-7-16(26)8-6-15/h3-10,17-24,27H,1-2,11-14H2/b10-9-/t17-,18+,19-,20+,21+,22-,23-,24+/m0/s1 |
| InChIKey |
AYTKAWYOBBXYPG-CURDRTFSSA-N |
| Molecular Weight |
505.405 g/mol |
| SMILES |
O[C@]1(\C=C/[C@]2(O[C@@]3([C@](O[C@]([C@](OC(c4ccc(cc4)Br)=O)(CC3)[H])(C=C)[H])(C[C@@]2(O[C@@](C1)(C=C)[H])[H])[H])[H])[H])[H] |
| SPLASH |
splash10-0020-0900000000-b445f0065e058a51d053 |
| Source of Spectrum |
J-59-2876-138 |
| Synonyms |
(1R,3S,6R,7S,9R,11S,13S,15R,16Z)-7,13-diethenyl-15-hydroxy-2,8,12-trioxatricyclo[9.6.0.0(3,9)]heptadec-16-en-6-yl 4-bromobenzoate |
| Wiley ID |
1399485 |
![(2S*,3R*,5aS*,13aR*,12aS*,6aR*,7Z,10S*,11R*)-3-[(4-Bromobenzoyl)oxy]-2,11-divinyl-10-hydroxy-2,3,4,5,5a,6a,10,11,12a,13,13a-dodecahydro-1,6,12-trioxacyclohepta[4,5]benzo[1,2]cyclooctene](/api/spectrum/7ln0EiUnGSz/structure.png?h=300&w=458 "(2S*,3R*,5aS*,13aR*,12aS*,6aR*,7Z,10S*,11R*)-3-[(4-Bromobenzoyl)oxy]-2,11-divinyl-10-hydroxy-2,3,4,5,5a,6a,10,11,12a,13,13a-dodecahydro-1,6,12-trioxacyclohepta[4,5]benzo[1,2]cyclooctene")
