| SpectraBase Spectrum ID |
B2yYlDzmnJo |
| Name |
Ibogamine-18-carboxylic acid, 16,17-didehydro-9,17-dihydro-9-hydroxy-12-methoxy-, methyl ester, (9.alpha.)- |
| Alternate Name(s) |
Methyl 9-hydroxy-12-methoxy-16,17-didehydro-9,17-dihydroibogamine-18-carboxylate
7-Hydroxy-1-dehydrovoacangine
9H-Voacangine, 9-hydroxy-
Voacangine hydroxyindolenine
Voacangine-7-hydroxyindolinine |
| CAS Registry Number |
3464-63-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O4 |
| InChI |
InChI=1S/C22H28N2O4/c1-4-14-9-13-11-21(20(25)28-3)18(14)24(12-13)8-7-22(26)16-10-15(27-2)5-6-17(16)23-19(21)22/h5-6,10,13-14,18,26H,4,7-9,11-12H2,1-3H3/t13-,14?,18+,21+,22?/m1/s1 |
| InChIKey |
AVRFPRAAVSCSSZ-NFIMKCFHSA-N |
| Molecular Weight |
384.476 g/mol |
| SMILES |
OC12c3c(ccc(OC)c3)N=C2[C@@]2(C[C@]3(CC([C@@]2(N(CC1)C3)[H])CC)[H])C(OC)=O |
| SPLASH |
splash10-0159-0937000000-fa607411ae95b9ae9bb8 |
| Source of Spectrum |
NB-0-1534-0 |
| Wiley ID |
55626 |
