Coenzyme Q10
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N103007_EF88
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N103007_EF88 contains the MS2 mass spectrum of Coenzyme Q10 with the InChIkey ACTIUHUUMQJHFO-UPTCCGCDSA-N.
Source: Coenzyme Q10
Chemical Info
| InChI | InChI=1S/C59H90O4/c1-44(2)24-15-25-45(3)26-16-27-46(4)28-17-29-47(5)30-18-31-48(6)32-19-33-49(7)34-20-35-50(8)36-21-37-51(9)38-22-39-52(10)40-23-41-53(11)42-43-55-54(12)56(60)58(62-13)59(63-14)57(55)61/h24,26,28,30,32,34,36,38,40,42H,15-23,25,27,29,31,33,35,37,39,41,43H2,1-14H3/b45-26+,46-28+,47-30+,48-32+,49-34+,50-36+,51-38+,52-40+,53-42+ |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)OC)OC)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C |
| InChI Key | ACTIUHUUMQJHFO-UPTCCGCDSA-N |
| Molecular Formula | C59H90O4 |
| Exact Mass | 862.684 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 4.0 International (CC BY 4.0) |
| Id | 435bd693-331a-42ff-991c-c332cdae49a7 |
| Package id | msbnk-antwerp_univ-metox_n103007_ef88 |
| Resource type | HTML |
| State | active |