| PDB CCD ID: | 2NV |
| Number of entries in BioLiP: | 8 |
| Chemical formula: | C13 H29 N O5 |
| InChI: | InChI=1S/C13H29NO5/c1-3-15-4-5-16-6-7-17-8-9-18-10-11-19-12-13(2)14/h13H,3-12,14H2,1-2H3/t13-/m1/s1 |
| InChIKey: | LPPZTQZWMYYVLK-CYBMUJFWSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | NC(C)COCCOCCOCCOCCOCC | | CACTVS 3.385 | CCOCCOCCOCCOCCOC[CH](C)N | CACTVS 3.385
OpenEye OEToolkits 1.7.6 | CCOCCOCCOCCOCCOC[C@@H](C)N | | OpenEye OEToolkits 1.7.6 | CCOCCOCCOCCOCCOCC(C)N |
|
| Name: | 3,6,9,12,15-pentaoxaoctadecan-17-amine;
Jeffamine ED-2001 |
| ZINC: | ZINC000098208218 |
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