(S,S)-(+)-Tetrandrine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR301530
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR301530 contains the MS2 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 |
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SMILES | COC1=C2OC3=CC=C(C[C@@H]4N(C)CCC5=CC(OC)=C(OC6=C7[C@H](CC(C=C1)=C2)N(C)CCC7=CC(OC)=C6OC)C=C45)C=C3 |
InChI Key | WVTKBKWTSCPRNU-KYJUHHDHSA-N |
Molecular Formula | C38H42N2O6 |
Exact Mass | 622.762 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | 77d04da3-a3ca-486b-8e96-530af8b33d78 |
Package id | msbnk-riken-pr301530 |
Resource type | HTML |
State | active |