| SpectraBase Spectrum ID |
7IAQWz31xuf |
| Name |
3-Oxo-7-hydroxy-3,7-secorhynchophylline |
| Alternate Name(s) |
Methyl (2Z)-2-{5-ethyl-1-[2-(3-hydroxy-2-oxo-2,3-dihydro-1H-indol-3-yl)ethyl]-2-oxo-4-piperidinyl}-3-methoxy-2-propenoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O6 |
| InChI |
InChI=1S/C22H28N2O6/c1-4-14-12-24(19(25)11-15(14)16(13-29-2)20(26)30-3)10-9-22(28)17-7-5-6-8-18(17)23-21(22)27/h5-8,13-15,28H,4,9-12H2,1-3H3,(H,23,27)/b16-13-/t14-,15-,22?/m0/s1 |
| InChIKey |
BSZMATVWFZYBEG-XLNIZTGZSA-N |
| Molecular Weight |
416.474 g/mol |
| SMILES |
N1c2c(C(CCN3C[C@@]([C@@](\C(C(=O)OC)=C\OC)(CC3=O)[H])(CC)[H])(C1=O)O)cccc2 |
| SPLASH |
splash10-014i-0391100000-4fadd1f4ba085d287d2a |
| Source of Spectrum |
E1-38-575-2 |
| Wiley ID |
1518218 |
