Voacamine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304653
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR304653 contains the MS2 mass spectrum of Voacamine with the InChIkey VCMIRXRRQJNZJT-UHFFFAOYSA-N.
Source: Voacamine
Chemical Info
| InChI | InChI=1S/C43H52N4O5/c1-7-24-15-23-20-43(42(49)52-6)39-27(13-14-47(21-23)40(24)43)29-19-36(50-4)30(17-34(29)45-39)31-16-28-25(8-2)22-46(3)35(37(28)41(48)51-5)18-32-26-11-9-10-12-33(26)44-38(31)32/h8-12,17,19,23-24,28,31,35,37,40,44-45H,7,13-16,18,20-22H2,1-6H3 |
|---|---|
| SMILES | CCC1CC2CN3CCC4=C(NC5=CC(C6CC7C(C(CC8=C6NC6=CC=CC=C86)N(C)CC7=CC)C(=O)OC)=C(OC)C=C45)C(C2)(C13)C(=O)OC |
| InChI Key | VCMIRXRRQJNZJT-UHFFFAOYSA-N |
| Molecular Formula | C43H52N4O5 |
| Exact Mass | 704.912 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-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | a4f13c02-a68a-4397-9260-b1cde9ff9c34 |
| Package id | msbnk-riken-pr304653 |
| Resource type | HTML |
| State | active |