(S,S)-(+)-Tetrandrine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80095
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML80095 contains the MS mass spectrum of (S,S)-(+)-Tetrandrine with the InChIkey WVTKBKWTSCPRNU-KYJUHHDHSA-N.
Source: (S,S)-(+)-Tetrandrine
Chemical Info
| InChI | InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1 |
|---|---|
| SMILES | CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC |
| InChI Key | WVTKBKWTSCPRNU-KYJUHHDHSA-N |
| Molecular Formula | C38H42N2O6 |
| Exact Mass | 622.304 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 9ee421ce-e98f-4f73-b5f2-64e420e6f0e8 |
| Package id | msbnk-washington_state_univ-bml80095 |
| Resource type | HTML |
| State | active |