7A8

(1R)-DIMETHYL-(4-METHYL-CYCLOHEX-3-ENYL)-AMINE

Created:	2002-11-08
Last modified:	2021-03-13

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1 entries where 7A8 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	1
Bond Count	27
Aromatic Bond Count	0

2D diagram of 7A8

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Chemical Component Summary
Name	(1R)-DIMETHYL-(4-METHYL-CYCLOHEX-3-ENYL)-AMINE
Synonyms	(4R)-7AZA-7,8-DIHYDROLIMONENE
Systematic Name (OpenEye OEToolkits)	(1R)-N,N,4-trimethylcyclohex-3-en-1-amine
Formula	C₉ H₁₇ N
Molecular Weight	139.238
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	N(C)(C)C1CC=C(C)CC1
SMILES	CACTVS	3.341	CN(C)[CH]1CCC(=CC1)C
SMILES	OpenEye OEToolkits	1.5.0	CC1=CCC(CC1)N(C)C
Canonical SMILES	CACTVS	3.341	CN(C)[C@@H]1CCC(=CC1)C
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC1=CC[C@@H](CC1)N(C)C
InChI	InChI	1.03	InChI=1S/C9H17N/c1-8-4-6-9(7-5-8)10(2)3/h4,9H,5-7H2,1-3H3/t9-/m0/s1
InChIKey	InChI	1.03	LDFVYCXKPXXSNO-VIFPVBQESA-N

Drug Info: DrugBank

DrugBank ID	DB01802
Name	(4R)-7-Aza-7,8-dihydrolimonene
Groups	experimental
Synonyms	(4R)-7-Aza-7,8-dihydrolimonene

Related Resource References

Resource Name	Reference
PubChem	447259

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.