| SpectraBase Spectrum ID |
B2hPyEMxPou |
| Name |
2-Naphthalenecarboxylic acid, 8-(1-formylethenyl)-3,4,4a,5,6,7,8,8a-octahydro-4-hydroxy-5-methyl-7-oxo-, (4.alpha.,4a.beta.,5.beta.,8.be ta.,8a.alpha.)-(-)- |
| CAS Registry Number |
115374-28-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O5 |
| InChI |
InChI=1S/C15H18O5/c1-7-3-11(17)14(8(2)6-16)10-4-9(15(19)20)5-12(18)13(7)10/h4,6-7,10,12-14,18H,2-3,5H2,1H3,(H,19,20)/t7-,10-,12-,13+,14-/m1/s1 |
| InChIKey |
HOMBCMTVOCZMMX-WUTMKBSZSA-N |
| Molecular Weight |
278.304 g/mol |
| SMILES |
OC(C1=C[C@@]2([C@@]([C@@](C1)(O)[H])([C@@](CC([C@@]2(C(=C)C=O)[H])=O)(C)[H])[H])[H])=O |
| SPLASH |
splash10-02tc-1190000000-0518f960bccc9c025838 |
| Source of Spectrum |
F-44-1600-1 |
| Synonyms |
(3E,4Z,7Z)-3.beta.-hydroxy-2(hydroxycarbonyl)-4.alpha.-methyl-7.alpha.-(3-hydroxy-2-propen-2-yl)transdecalene
(4R,4aS,5R,8S,8aR)-8-(1-formylvinyl)-4-hydroxy-5-methyl-7-oxo-3,4,4a,5,6,7,8,8a-octahydro-2-naphthalenecarboxylic acid
PANAL |
| Wiley ID |
1281880 |
