| SpectraBase Spectrum ID |
4OJrVX0btBg |
| Name |
Psychotrine |
| Alternate Name(s) |
7',10,11-trimethoxy-1',2'-didehydroemetan-6'-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H36N2O4 |
| InChI |
InChI=1S/C28H36N2O4/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23/h12-15,17,20,24,31H,5-11,16H2,1-4H3/t17-,20-,24-/m0/s1 |
| InChIKey |
NCALAYAMQHIWMN-REIDKSKDSA-N |
| Molecular Weight |
464.606 g/mol |
| SMILES |
Oc1cc2c(C(C[C@@]3([C@](CN4[C@](c5cc(OC)c(cc5CC4)OC)(C3)[H])(CC)[H])[H])=NCC2)cc1OC |
| SPLASH |
splash10-006x-0390100000-bd9efcf47719b5f158a0 |
| Source of Spectrum |
X2-53-1014-2 |
| Wiley ID |
1603675 |
