| SpectraBase Spectrum ID |
Ej95YCey8zr |
| Name |
16 R, 16-Decarbomethoxytetrahydraceeomine |
| Comments |
Note: The molecular formula of the structure shown is C21H24N2O3 - which differs from the formula reported for the mass spectrum (C40H54N4O2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H54N4O2 |
| InChI |
InChI=1S/C21H24N2O3/c1-3-12-10-23-17-9-15(12)21(11-24,20(25)26-2)18(23)8-14-13-6-4-5-7-16(13)22-19(14)17/h3-7,15,17-18,22,24H,8-11H2,1-2H3/b12-3-/t15-,17?,18+,21-/m1/s1 |
| InChIKey |
RCEFXZXHYFOPIE-IUSJSWLNSA-N |
| Molecular Weight |
352.434 g/mol |
| SMILES |
[nH]1c2ccccc2c2c1C1N3[C@]([C@@](CO)([C@@](C1)([H])\C(C3)=C/C)C(=O)OC)(C2)[H] |
| SPLASH |
splash10-004i-3920000000-35ea3f236c78894a4c2b |
| Source of Spectrum |
PS-0-0-65 |
| Synonyms |
(S)-3-Ethylidene-13-hydroxymethyl-1,3,4,7,12,12b-hexahydro-2H,6H-2,6-methano-indolo[2,3-a]quinolizine-13-carboxylic acid methyl ester |
| Wiley ID |
551569 |
