| SpectraBase Spectrum ID |
3J3LQM41m3H |
| Name |
(1S,5S,8aS)-5-(Methoxycarbonyl)-5,8a-dimethyl-1-(4-methyl-3-oxopentyl)-1,4,4a,5,6,7, 8,8a-octahydronaphthalene-2-carboxylic acid |
| Alternate Name(s) |
(1S,5S,8aS)-5-(methoxycarbonyl)-5,8a-dimethyl-1-(4-methyl-3-oxopentyl)-1,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O5 |
| InChI |
InChI=1S/C21H32O5/c1-13(2)16(22)9-8-15-14(18(23)24)7-10-17-20(15,3)11-6-12-21(17,4)19(25)26-5/h7,13,15,17H,6,8-12H2,1-5H3,(H,23,24)/t15-,17?,20-,21+/m1/s1 |
| InChIKey |
MKFHXUIWHUXVDC-KXGHRTJOSA-N |
| Literature Reference DOI |
10.1021/ol202354g |
| Molecular Weight |
364.482 g/mol |
| SMILES |
OC(C1=CCC2[C@@](C)(C(OC)=O)CCC[C@]2(C)[C@@]1(CCC(C(C)C)=O)[H])=O |
| SPLASH |
splash10-03fr-4790000000-617ed0c5726905a06d81 |
| Source of Spectrum |
A1-13-5788/SMS11-30 |
| Wiley ID |
1753876 |
