(-)-Podophyllotoxin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303985
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR303985 contains the MS2 mass spectrum of (-)-Podophyllotoxin with the InChIkey YJGVMLPVUAXIQN-XVVDYKMHSA-N.
Source: (-)-Podophyllotoxin
Chemical Info
| InChI | InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1 |
|---|---|
| SMILES | COC1=CC(=CC(OC)=C1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)C2=CC3=C(OCO3)C=C12 |
| InChI Key | YJGVMLPVUAXIQN-XVVDYKMHSA-N |
| Molecular Formula | C22H22O8 |
| Exact Mass | 414.410 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 | 0455a197-88fa-43ca-9952-1ca87763ac4a |
| Package id | msbnk-riken-pr303985 |
| Resource type | HTML |
| State | active |