| PDB CCD ID: | VSD |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C18 H37 N O2 |
| InChI: | InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17,20H,2-16,19H2,1H3/t17-/m0/s1 |
| InChIKey: | KBUNOSOGGAARKZ-KRWDZBQOSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCCCCCC(=O)[C@H](CO)N | | CACTVS 3.385 | CCCCCCCCCCCCCCCC(=O)[CH](N)CO | | OpenEye OEToolkits 2.0.7 | CCCCCCCCCCCCCCCC(=O)C(CO)N | | CACTVS 3.385 | CCCCCCCCCCCCCCCC(=O)[C@@H](N)CO | | ACDLabs 12.01 | C(C(C(N)CO)=O)CCCCCCCCCCCCCC |
|
| Name: | 3-Dehydrosphinganine;
(2S,6E)-2-amino-1-hydroxyoctadec-6-en-3-one |
| ZINC: | ZINC000056870932 |
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