| SpectraBase Spectrum ID |
EsAa7PTirr5 |
| Name |
Dimethyl ester of (1S-(1.alpha.,2.beta.(S*),4a.beta.,8a.alpha.))-.alpha.2-acetyldecahydro-2,5,5,8a-tetramethyl-1,2-naphthalenediacetic acid |
| Alternate Name(s) |
Methyl 2-[(1S,2R,4aR,8aR)-1-(2-methoxy-2-oxoethyl)-2,5,5,8a-tetramethyldecahydro-2-naphthalenyl]-3-oxobutanoate |
| CAS Registry Number |
72264-67-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O5 |
| InChI |
InChI=1S/C22H36O5/c1-14(23)18(19(25)27-7)22(5)12-9-15-20(2,3)10-8-11-21(15,4)16(22)13-17(24)26-6/h15-16,18H,8-13H2,1-7H3/t15-,16+,18?,21-,22-/m1/s1 |
| InChIKey |
ZFHXBVQVSINEBI-SZIZMPQUSA-N |
| Molecular Weight |
380.525 g/mol |
| SMILES |
[C@]1([C@]([C@@]2(CCCC([C@]2(CC1)[H])(C)C)C)(CC(=O)OC)[H])(C(C(=O)OC)C(=O)C)C |
| SPLASH |
splash10-00dr-0920000000-b1101cf0f7642e8725ff |
| Source of Spectrum |
J-45-515-0 |
| Wiley ID |
1359832 |
