N-Heptadecanoyl-D-erythro-Sphingosine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N101927_9C9C
Dataset description:
This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N101927_9C9C contains the MS2 mass spectrum of N-Heptadecanoyl-D-erythro-Sphingosine with the InChIkey...
Chemical Info
| InChI | InChI=1S/C35H69NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(39)36-33(32-37)34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h28,30,33-34,37-38H,3-27,29,31-32H2,1-2H3,(H,36,39)/b30-28+/t33-,34+/m0/s1 |
|---|---|
| SMILES | OC[C@H](NC(CCCCCCCCCCCCCCCC)=O)[C@H](O)/C=C/CCCCCCCCCCCCC |
| InChI Key | ICWGMOFDULMCFL-QKSCFGQVSA-N |
| Molecular Formula | C35H69NO3 |
| Exact Mass | 551.528 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 | a08e149a-20b5-4a99-872d-28da0c98814e |
| Package id | msbnk-antwerp_univ-metox_n101927_9c9c |
| Resource type | HTML |
| State | active |