| SpectraBase Spectrum ID |
E3C30qEOJNg |
| Name |
Methyl 12-[5' / 3'-(4''-(methoxyphenyl)pyrazol]-3 / 5-dehydroabietate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H38N2O3 |
| InChI |
InChI=1S/C31H38N2O3/c1-19(2)23-16-21-10-13-28-30(3,14-7-15-31(28,4)29(34)36-6)25(21)17-24(23)27-18-26(32-33-27)20-8-11-22(35-5)12-9-20/h8-9,11-12,16-19,28H,7,10,13-15H2,1-6H3,(H,32,33)/t28?,30-,31-/m1/s1 |
| InChIKey |
WAGRNAUJHZWKAJ-ZSUYXASHSA-N |
| Molecular Weight |
486.656 g/mol |
| SMILES |
[nH]1c(cc(n1)-c1cc2[C@@]3(C([C@@](C(=O)OC)(C)CCC3)CCc2cc1C(C)C)C)-c1ccc(OC)cc1 |
| SPLASH |
splash10-000i-2523900000-ebc9078b106f9d949d56 |
| Source of Spectrum |
AH-129-1193-9 |
| Synonyms |
(1R,4aS)-7-Isopropyl-6-[5-(4-methoxy-phenyl)-1H-pyrazol-3-yl]-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydro-phenanthrene-1-carboxylic acid methyl ester
Methyl 12-[5' /,3'-(4''-(methoxyphenyl)pyrazol]-3 , 5-dehydroabietate |
| Wiley ID |
770461 |
