Oleanolic acid
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81845
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML81845 contains the MS mass spectrum of Oleanolic acid with the InChIkey MIJYXULNPSFWEK-UHFFFAOYSA-N.
Source: Oleanolic acid
Chemical Info
| InChI | InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33) |
|---|---|
| SMILES | CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C |
| InChI Key | MIJYXULNPSFWEK-UHFFFAOYSA-N |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360 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 | cbf34e3c-93f6-4afb-bb06-5f811d851e54 |
| Package id | msbnk-washington_state_univ-bml81845 |
| Resource type | HTML |
| State | active |