ERGOSTEROL
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP011384
Dataset description:
This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP011384 contains the MS mass spectrum of ERGOSTEROL with the InChIkey DNVPQKQSNYMLRS-NBEWGGKZSA-N.
Source: ERGOSTEROL
Chemical Info
| InChI | InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20-,22+,24-,25+,26+,27+,28-/m1/s1 |
|---|---|
| SMILES | C(=CC([H])(C)C(C)C)C(C(C4)([H])C(C3(C4)[H])(CCC(C=23)(C(C1)(C)C(=CC2)CC(O)C1)[H])C)([H])C |
| InChI Key | DNVPQKQSNYMLRS-NBEWGGKZSA-N |
| Molecular Formula | C28H44O |
| Exact Mass | 396.339 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 | 3c8e5a05-033f-436f-8742-e673c2a3a2bf |
| Package id | msbnk-fac_eng_univ_tokyo-jp011384 |
| Resource type | HTML |
| State | active |