| SpectraBase Spectrum ID |
L2DDqlU1Whm |
| Name |
5H-Dibenzo[a,c]cycloheptene-3-carboxylic acid, 5-amino-6,7-dihydro-9,10,11-trimethoxy-, methyl ester, (S)- |
| Alternate Name(s) |
Desacetylallocolchicine
methyl (5S)-5-amino-9,10,11-trimethoxy-6,7-dihydro-5H-dibenzo[a,c]cycloheptene-3-carboxylate
N-Deacetylallocolchicine |
| CAS Registry Number |
81573-24-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H23NO5 |
| InChI |
InChI=1S/C20H23NO5/c1-23-16-10-11-6-8-15(21)14-9-12(20(22)26-4)5-7-13(14)17(11)19(25-3)18(16)24-2/h5,7,9-10,15H,6,8,21H2,1-4H3/t15-/m0/s1 |
| InChIKey |
OFHCYBGBHHXRTJ-HNNXBMFYSA-N |
| Molecular Weight |
357.406 g/mol |
| SMILES |
N[C@@]1(c2c(-c3c(c(OC)c(cc3CC1)OC)OC)ccc(C(=O)OC)c2)[H] |
| SPLASH |
splash10-052f-0009000000-a2fedb7fde1e4d9ad15d |
| Source of Spectrum |
SB-35-680-0 |
| Wiley ID |
1346478 |
![5H-Dibenzo[a,c]cycloheptene-3-carboxylic acid, 5-amino-6,7-dihydro-9,10,11-trimethoxy-, methyl ester, (S)-](/api/spectrum/L2DDqlU1Whm/structure.png?h=300&w=458 "5H-Dibenzo[a,c]cycloheptene-3-carboxylic acid, 5-amino-6,7-dihydro-9,10,11-trimethoxy-, methyl ester, (S)-")
