| SpectraBase Spectrum ID |
C9UKv3fHF4Z |
| Name |
18,19-Secoyohimban-19-oic acid, 20,21-didehydro-18-hydroxy-16-(hydroxymethyl)-, methyl ester, (3.beta.,16R)-(.+-.)- |
| CAS Registry Number |
122382-75-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26N2O4 |
| InChI |
InChI=1S/C21H26N2O4/c1-27-21(26)17-11-23-8-6-15-14-4-2-3-5-18(14)22-20(15)19(23)10-16(17)13(12-25)7-9-24/h2-5,11,13,16,19,22,24-25H,6-10,12H2,1H3/t13-,16?,19+/m0/s1 |
| InChIKey |
PGMMBKPHGVHACY-SDFDQKQISA-N |
| Molecular Weight |
370.449 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1[C@@]1(N(C=C(C([C@@](CCO)(CO)[H])C1)C(=O)OC)CC2)[H] |
| SPLASH |
splash10-001i-0094000000-894070a7657d24b2b028 |
| Source of Spectrum |
K-122-2028-7 |
| Synonyms |
Indolo[2,3-a]quinolizine, 18,19-secoyohimban-19-oic acid deriv.
Methyl (12bR)-2-[(1R)-3-hydroxy-1-(hydroxymethyl)propyl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate |
| Wiley ID |
1354376 |
