| SpectraBase Spectrum ID |
EOzDVJMqDyh |
| Name |
2-Pentenoic acid, 5-(decahydro-3,7-dihydroxy-5,5,8A-trimethyl-2-oxo-1-naphthalenyl)-3-methyl-, methyl ester, [1S-[1.alpha.(E),3.beta.,4A.beta.,7.beta.,8A.alpha.]]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.224974125 u |
| Formula |
C20H32O5 |
| InChI |
InChI=1S/C20H32O5/c1-12(8-17(23)25-5)6-7-14-18(24)15(22)9-16-19(2,3)10-13(21)11-20(14,16)4/h8,13-16,21-22H,6-7,9-11H2,1-5H3/b12-8+/t13-,14-,15+,16-,20+/m1/s1 |
| InChIKey |
UYVLDKOHYHFOJP-OILKMLJRSA-N |
| Molecular Weight |
352.471 g/mol |
| SMILES |
[C@]12([C@@](C(C)(C)C[C@](C2)(O)[H])(C[C@@](C([C@]1(CC\C(=C\C(=O)OC)C)[H])=O)(O)[H])[H])C |
![2-Pentenoic acid, 5-(decahydro-3,7-dihydroxy-5,5,8a-trimethyl-2-oxo-1-naphthalenyl)-3-methyl-, methyl ester, [1S-[1.alpha.(E),3.beta.,4a.beta.,7.beta.,8a.alpha.]]-](/api/spectrum/EOzDVJMqDyh/structure.png?h=300&w=458 "2-Pentenoic acid, 5-(decahydro-3,7-dihydroxy-5,5,8a-trimethyl-2-oxo-1-naphthalenyl)-3-methyl-, methyl ester, [1S-[1.alpha.(E),3.beta.,4a.beta.,7.beta.,8a.alpha.]]-")
