CKC

(3S)-3,7-diaminoheptan-2-one

Created:	2014-09-15
Last modified:	2024-09-27

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1 entries where CKC is covalently linked to polymer or other heterogen groups 3 entries where CKC is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	1
Bond Count	25
Aromatic Bond Count	0

2D diagram of CKC

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Chemical Component Summary
Name	(3S)-3,7-diaminoheptan-2-one
Systematic Name (OpenEye OEToolkits)	(3S)-3,7-bis(azanyl)heptan-2-one
Formula	C₇ H₁₆ N₂ O
Molecular Weight	144.215
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(C)C(N)CCCCN
SMILES	CACTVS	3.385	CC(=O)[CH](N)CCCCN
SMILES	OpenEye OEToolkits	1.7.6	CC(=O)C(CCCCN)N
Canonical SMILES	CACTVS	3.385	CC(=O)[C@@H](N)CCCCN
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(=O)[C@H](CCCCN)N
InChI	InChI	1.03	InChI=1S/C7H16N2O/c1-6(10)7(9)4-2-3-5-8/h7H,2-5,8-9H2,1H3/t7-/m0/s1
InChIKey	InChI	1.03	FADKJNSSIWTVAI-ZETCQYMHSA-N

Related Resource References

Resource Name	Reference
PubChem	5288718

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