N-oleoyl-D-erythro-sphingosine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N102054_5C2A
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N102054_5C2A contains the MS2 mass spectrum of N-oleoyl-D-erythro-sphingosine with the InChIkey OBFSLMQLPNKVRW-RHPAUOISSA-N.
Source: N-oleoyl-D-erythro-sphingosine
Chemical Info
| InChI | InChI=1S/C36H69NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,29,31,34-35,38-39H,3-16,19-28,30,32-33H2,1-2H3,(H,37,40)/b18-17-,31-29+/t34-,35+/m0/s1 |
|---|---|
| SMILES | CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)NC(=O)CCCCCCC/C=C\CCCCCCCC)O |
| InChI Key | OBFSLMQLPNKVRW-RHPAUOISSA-N |
| Molecular Formula | C36H69NO3 |
| Exact Mass | 563.528 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 | d35a95fc-a364-40b7-8f75-f4656af32551 |
| Package id | msbnk-antwerp_univ-metox_n102054_5c2a |
| Resource type | HTML |
| State | active |