| SpectraBase Spectrum ID |
AipeZlse6oN |
| Name |
Methyl (3S,5R)-3,5-Dihydroxy-7-{(1'S,2'S,4a'R,8'S,8a'S)-2'-methyl-8'-[(S)-2-methylbutanoyloxy]-1',2',4a',5',6',7',8',8a'-octahydronaphthalene-1'-yl}heptanoate 3,5-O-(ethylborate) |
| Alternate Name(s) |
(1S,4aR,7S,8S,8aR)-8-{2-[(4R,6R)-2-ethyl-6-(2-methoxy-2-oxoethyl)-1,3,2-dioxaborinan-4-yl]ethyl}-7-methyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl (2S)-2-methylbutanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H43BO6 |
| InChI |
InChI=1S/C26H43BO6/c1-6-17(3)26(29)31-23-10-8-9-19-12-11-18(4)22(25(19)23)14-13-20-15-21(16-24(28)30-5)33-27(7-2)32-20/h11-12,17-23,25H,6-10,13-16H2,1-5H3/t17-,18-,19+,20+,21+,22-,23-,25-/m0/s1 |
| InChIKey |
FHLFAMSACLMLBE-XLACZJMWSA-N |
| Molecular Weight |
462.434 g/mol |
| SMILES |
[C@@]1(OB(O[C@@](C1)(CC[C@@]1([C@]2([C@@](OC(=O)[C@](CC)(C)[H])(CCC[C@]2([H])C=C[C@@]1(C)[H])[H])[H])[H])[H])CC)(CC(=O)OC)[H] |
| SPLASH |
splash10-03dr-0596200000-55cd6d124afd9c1df19a |
| Source of Spectrum |
KC-0-2428-59 |
| Wiley ID |
781866 |
![Methyl (3S,5R)-3,5-Dihydroxy-7-{(1'S,2'S,4a'R,8'S,8a'S)-2'-methyl-8'-[(S)-2-methylbutanoyloxy]-1',2',4a',5',6',7',8',8a'-octahydronaphthalene-1'-yl}heptanoate 3,5-O-(ethylborate)](/api/spectrum/AipeZlse6oN/structure.png?h=300&w=458 "Methyl (3S,5R)-3,5-Dihydroxy-7-{(1'S,2'S,4a'R,8'S,8a'S)-2'-methyl-8'-[(S)-2-methylbutanoyloxy]-1',2',4a',5',6',7',8',8a'-octahydronaphthalene-1'-yl}heptanoate 3,5-O-(ethylborate)")
