SpectraBase Spectrum ID |
Hnad2bkotSm |
Name |
4-Ethyl-2,3,4alpha,4aalpha,5,6,7,12-octahydro-2-methyl-6-oxopyrido(3',4':4,5)cyclohept(1,2-b)in dole-12aalpha(1H)-carboxylic acid methyl ester |
Alternate Name(s) |
Epiervatamine
Ervatamine |
CAS Registry Number |
33257-13-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H26N2O3 |
InChI |
InChI=1S/C21H26N2O3/c1-4-13-11-23(2)12-21(20(25)26-3)10-15-14-7-5-6-8-17(14)22-19(15)18(24)9-16(13)21/h5-8,13,16,22H,4,9-12H2,1-3H3/t13-,16+,21+/m1/s1 |
InChIKey |
METLQVFFFUYXNT-QTPGKHNVSA-N |
Molecular Weight |
354.450 g/mol |
SMILES |
[nH]1c2c(c3c1C(C[C@@]1([C@](C3)(CN(C[C@]1(CC)[H])C)C(=O)OC)[H])=O)cccc2 |
SPLASH |
splash10-0f8a-0955000000-a0e32da4891183187537 |
Source of Spectrum |
B-28-1837-0 |
Wiley ID |
1344743 |