| SpectraBase Spectrum ID |
IC5ppzsKRTA |
| Name |
Colchicine |
| CAS Registry Number |
64-86-8 |
| Classification |
Gout suppressant |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
399.168187523 u |
| Formula |
C22H25NO6 |
| InChI |
InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24) |
| InChIKey |
IAKHMKGGTNLKSZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
399.443 g/mol |
| Nominal Mass |
399 u |
| Quality |
962 |
| Retention Index |
3055 |
| SMILES |
C=12C=3C(C(NC(=O)C)CCC2=CC(=C(C1OC)OC)OC)=CC(C(=CC3)OC)=O |
| SPLASH |
splash10-03ea-2594000000-5eede31d3380421e5c17 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Kolchizin
(S)-N-(5,6,7,9-Tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl) acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030978 |
