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2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 3-(dodecanoylamino)propanoic acid

2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 3-(dodecanoylamino)propanoic acid

Systemtic Name:2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 3-(dodecanoylamino)propanoic acid
Openeye Name:2-amino-5-guanidino-pentanoic acid; 3-(dodecanoylamino)propanoic acid
CAS Name:2-amino-5-(diaminomethylideneamino)pentanoic acid; 3-(1-oxododecylamino)propanoic acid
IUPAC Name:2-amino-5-(diaminomethylideneamino)pentanoic acid; 3-(dodecanoylamino)propanoic acid
Traditional Name:2-amino-5-guanidino-valeric acid; 3-(lauroylamino)propionic acid
Formula: C21H43N5O5
MolecularWeight: 445.59662
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCCC(=O)O.C(CC(C(=O)O)N)CN=C(N)N


Isomeric SMILES

CCCCCCCCCCCC(=O)NCCC(=O)O.C(CC(C(=O)O)N)CN=C(N)N


InChI

InChI=1S/C15H29NO3.C6H14N4O2/c1-2-3-4-5-6-7-8-9-10-11-14(17)16-13-12-15(18)19;7-4(5(11)12)2-1-3-10-6(8)9/h2-13H2,1H3,(H,16,17)(H,18,19);4H,1-3,7H2,(H,11,12)(H4,8,9,10)


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