| SpectraBase Spectrum ID |
qnwUPgGTWt |
| Name |
2-Pentenoic acid, 5-[decahydro-5-(hydroxymethyl)-5,8A-dimethyl-2-methylene-6-[(2-methyl-1-oxo-2-butenyl)oxy]-1-naphthalenyl]-3-methyl-, [1R-[1.alpha.(E),4A.beta.,5.beta.,6.alpha.(Z),8A.alpha.]]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.271924319 u |
| Formula |
C25H38O5 |
| InChI |
InChI=1S/C25H38O5/c1-7-17(3)23(29)30-21-12-13-24(5)19(10-8-16(2)14-22(27)28)18(4)9-11-20(24)25(21,6)15-26/h7,14,19-21,26H,4,8-13,15H2,1-3,5-6H3,(H,27,28)/b16-14+,17-7-/t19-,20+,21-,24+,25+/m1/s1 |
| InChIKey |
RFGKNIQKUIOMJZ-ODUJZYEISA-N |
| Molecular Weight |
418.574 g/mol |
| SMILES |
[C@]12([C@@]([C@@](CO)(C)[C@@](CC2)(OC(\C(=C/C)C)=O)[H])(CCC([C@]1(CC\C(=C\C(=O)O)C)[H])=C)[H])C |
![2-Pentenoic acid, 5-[decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-6-[(2-methyl-1-oxo-2-butenyl)oxy]-1-naphthalenyl]-3-methyl-, [1R-[1.alpha.(E),4a.beta.,5.beta.,6.alpha.(Z),8a.alpha.]]-](/api/spectrum/qnwUPgGTWt/structure.png?h=300&w=458 "2-Pentenoic acid, 5-[decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-6-[(2-methyl-1-oxo-2-butenyl)oxy]-1-naphthalenyl]-3-methyl-, [1R-[1.alpha.(E),4a.beta.,5.beta.,6.alpha.(Z),8a.alpha.]]-")
