2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; hexadecyl phosphate

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; hexadecyl phosphate Openeye Name: 2-amino-5-guanidino-pentanoic acid; hexadecyl phosphate CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; hexadecyl phosphate IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; hexadecyl phosphate Traditional Name: 2-amino-5-guanidino-valeric acid; cetyl phosphate Formula: C22H47N4O6P-2 MolecularWeight: 494.605541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOP(=O)([O-])[O-].C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOP(=O)([O-])[O-].C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C16H35O4P.C6H14N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19;7-4(5(11)12)2-1-3-10-6(8)9/h2-16H2,1H3,(H2,17,18,19);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/p-2