| SpectraBase Spectrum ID |
Ic2dK4wpQWq |
| Name |
9.10-Di-O-deacetyltaxinine |
| Alternate Name(s) |
9,10-Di-O-deacetyltaxuspine C
(2beta,3beta,5beta,8alpha,9beta,10alpha)-2-(acetyloxy)-9,10-dihydroxy-13-oxotaxa-4(20),11-dien-5-yl (2E)-3-phenyl-2-propenoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H38O7 |
| InChI |
InChI=1S/C31H38O7/c1-17-22(33)16-21-28(37-19(3)32)26-18(2)23(38-24(34)13-12-20-10-8-7-9-11-20)14-15-31(26,6)29(36)27(35)25(17)30(21,4)5/h7-13,21,23,26-29,35-36H,2,14-16H2,1,3-6H3/b13-12+/t21-,23-,26-,27+,28+,29-,31+/m0/s1 |
| InChIKey |
VINWCUNFNJBSQA-IRZWYNESSA-N |
| Molecular Weight |
522.638 g/mol |
| SMILES |
O[C@@]1(C=2C([C@]([C@]([C@]3([C@]([C@]1(O)[H])(CC[C@@](C3=C)(OC(\C=C\c1ccccc1)=O)[H])C)[H])(OC(=O)C)[H])(CC(C2C)=O)[H])(C)C)[H] |
| SPLASH |
splash10-000x-9800110000-59fe30352d4647884be1 |
| Source of Spectrum |
KC-0-418-4 |
| Wiley ID |
824225 |
