0HH

L-gamma-glutamyl-S-nonyl-L-cysteinylglycine

Created:	2009-02-04
Last modified:	2011-06-04

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1 entries where 0HH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	64
Chiral Atom Count	2
Bond Count	63
Aromatic Bond Count	0

2D diagram of 0HH

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Chemical Component Summary
Name	L-gamma-glutamyl-S-nonyl-L-cysteinylglycine
Systematic Name (OpenEye OEToolkits)	(2S)-2-azanyl-5-[[(2R)-1-(carboxymethylamino)-3-nonylsulfanyl-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
Formula	C₁₉ H₃₅ N₃ O₆ S
Molecular Weight	433.563
Type	PEPTIDE-LIKE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(NC(C(=O)NCC(=O)O)CSCCCCCCCCC)CCC(C(=O)O)N
SMILES	CACTVS	3.370	CCCCCCCCCSC[CH](NC(=O)CC[CH](N)C(O)=O)C(=O)NCC(O)=O
SMILES	OpenEye OEToolkits	1.7.0	CCCCCCCCCSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N
Canonical SMILES	CACTVS	3.370	CCCCCCCCCSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.0	CCCCCCCCCSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N
InChI	InChI	1.03	InChI=1S/C19H35N3O6S/c1-2-3-4-5-6-7-8-11-29-13-15(18(26)21-12-17(24)25)22-16(23)10-9-14(20)19(27)28/h14-15H,2-13,20H2,1H3,(H,21,26)(H,22,23)(H,24,25)(H,27,28)/t14-,15-/m0/s1
InChIKey	InChI	1.03	LUOWFOMONLCPJP-GJZGRUSLSA-N

Related Resource References

Resource Name	Reference
PubChem	444057

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.