2YH

N~5~-D-ornithyl-L-ornithine

Created:	2014-04-14
Last modified:	2014-04-23

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1 entries where 2YH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	2
Bond Count	38
Aromatic Bond Count	0

2D diagram of 2YH

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Chemical Component Summary
Name	N~5~-D-ornithyl-L-ornithine
Systematic Name (OpenEye OEToolkits)	(2S)-2-azanyl-5-[[(2R)-2,5-bis(azanyl)pentanoyl]amino]pentanoic acid
Formula	C₁₀ H₂₂ N₄ O₃
Molecular Weight	246.307
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(N)CCCNC(=O)C(N)CCCN
SMILES	CACTVS	3.385	NCCC[CH](N)C(=O)NCCC[CH](N)C(O)=O
SMILES	OpenEye OEToolkits	1.7.6	C(CC(C(=O)NCCCC(C(=O)O)N)N)CN
Canonical SMILES	CACTVS	3.385	NCCC[C@@H](N)C(=O)NCCC[C@H](N)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C(C[C@H](C(=O)NCCC[C@@H](C(=O)O)N)N)CN
InChI	InChI	1.03	InChI=1S/C10H22N4O3/c11-5-1-3-7(12)9(15)14-6-2-4-8(13)10(16)17/h7-8H,1-6,11-13H2,(H,14,15)(H,16,17)/t7-,8+/m1/s1
InChIKey	InChI	1.03	MCMLHDBHZRLOED-SFYZADRCSA-N

Related Resource References

Resource Name	Reference
PubChem	73659215

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