| SpectraBase Spectrum ID |
4Tv9wYhVG5n |
| Name |
18,19-Secoyohimban-19-oic acid, 16,17,20,21-tetradehydro-16-formyl-, methyl ester, (15beta,16E)- |
| CAS Registry Number |
5523-37-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22N2O3 |
| InChI |
InChI=1S/C21H22N2O3/c1-3-13(12-24)16-10-19-20-15(14-6-4-5-7-18(14)22-20)8-9-23(19)11-17(16)21(25)26-2/h3-7,11-12,16,19,22H,8-10H2,1-2H3/b13-3-/t16-,19?/m1/s1 |
| InChIKey |
NTVLUSJWJRSPSM-UMKWFBPXSA-N |
| Molecular Weight |
350.418 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1C1N(CC2)C=C([C@](C1)(\C(=C/C)C=O)[H])C(=O)OC |
| SPLASH |
splash10-0wb9-0595000000-5d61b3b2424314994a79 |
| Source of Spectrum |
SD-1981-0-0 |
| Synonyms |
Vallesiachotamine |
| Wiley ID |
1342062 |
