2NV

3,6,9,12,15-pentaoxaoctadecan-17-amine

Created:	2014-04-21
Last modified:	2021-03-01

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4 entries where 2NV is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	48
Chiral Atom Count	1
Bond Count	47
Aromatic Bond Count	0

2D diagram of 2NV

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Chemical Component Summary
Name	3,6,9,12,15-pentaoxaoctadecan-17-amine
Synonyms	Jeffamine ED-2001
Systematic Name (OpenEye OEToolkits)	(2R)-1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-amine
Formula	C₁₃ H₂₉ N O₅
Molecular Weight	279.373
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	NC(C)COCCOCCOCCOCCOCC
SMILES	CACTVS	3.385	CCOCCOCCOCCOCCOC[CH](C)N
SMILES	OpenEye OEToolkits	1.7.6	CCOCCOCCOCCOCCOCC(C)N
Canonical SMILES	CACTVS	3.385	CCOCCOCCOCCOCCOC[C@@H](C)N
Canonical SMILES	OpenEye OEToolkits	1.7.6	CCOCCOCCOCCOCCOC[C@@H](C)N
InChI	InChI	1.03	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	InChI	1.03	LPPZTQZWMYYVLK-CYBMUJFWSA-N

Related Resource References

Resource Name	Reference
PubChem	124081749

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.