| SpectraBase Spectrum ID |
DbFF6o4Cffj |
| Name |
(13S*,14R*)-13-Hydoxy-13-methyl-2,3-dimethoxy-9,10-methylene-dioxy-8- oxotetrahydroprotoberberine |
| Alternate Name(s) |
(6S,6aR)-6-hydroxy-8,9-dimethoxy-6-methyl-6,6a,11,12-tetrahydro-14H-[1,3]dioxolo[4,5-h]isoquino[2,1-b]isoquinolin-14-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21NO6 |
| InChI |
InChI=1S/C21H21NO6/c1-21(24)13-4-5-14-18(28-10-27-14)17(13)20(23)22-7-6-11-8-15(25-2)16(26-3)9-12(11)19(21)22/h4-5,8-9,19,24H,6-7,10H2,1-3H3/t19-,21+/m1/s1 |
| InChIKey |
IRBQHIBKLZRICS-CTNGQTDRSA-N |
| Molecular Weight |
383.400 g/mol |
| SMILES |
O[C@@]1([C@@]2(N(C(c3c4c(OCO4)ccc13)=O)CCc1cc(OC)c(cc21)OC)[H])C |
| SPLASH |
splash10-0006-0900000000-13da7b9cf601e66b8b72 |
| Source of Spectrum |
I-62-1397-0 |
| Wiley ID |
1361076 |
