| SpectraBase Compound ID | KbaWG0rhjGG |
|---|---|
| InChI | InChI=1S/C35H67NO3/c1-4-5-6-7-8-9-10-11-15-18-21-24-27-30-35(39)36-33(31-37)34(38)29-26-23-20-17-14-12-13-16-19-22-25-28-32(2)3/h14,17,26,29,32-34,37-38H,4-13,15-16,18-25,27-28,30-31H2,1-3H3,(H,36,39)/b17-14+,29-26+/t33-,34?/m0/s1 |
| InChIKey | BLYVYOPIHMVKTG-JVYRKTSLSA-N |
| Mol Weight | 549.9 g/mol |
| Molecular Formula | C35H67NO3 |
| Exact Mass | 549.512095 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E5uV9LlFUld |
|---|---|
| Name | Ceramide 3 |
| Alternate Name(s) | N-Palmitoyl-(2S,3R)-17-methyloctadecasphinga-4(E),8(E)-dienine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H67NO3 |
| InChI | InChI=1S/C35H67NO3/c1-4-5-6-7-8-9-10-11-15-18-21-24-27-30-35(39)36-33(31-37)34(38)29-26-23-20-17-14-12-13-16-19-22-25-28-32(2)3/h14,17,26,29,32-34,37-38H,4-13,15-16,18-25,27-28,30-31H2,1-3H3,(H,36,39)/b17-14+,29-26+/t33-,34?/m0/s1 |
| InChIKey | BLYVYOPIHMVKTG-JVYRKTSLSA-N |
| Molecular Weight | 549.925 g/mol |
| SMILES | N([C@@](CO)(C(\C=C\CC\C=C\CCCCCCCC(C)C)O)[H])C(=O)CCCCCCCCCCCCCCC |
| SPLASH | splash10-001i-2091000000-429f4ae1190577fc2ce7 |
| Source of Spectrum | G4-58-951-3 |
| Wiley ID | 1605932 |