MCM

7-AMINO-4-METHYL-CHROMEN-2-ONE

Created:	2003-01-09
Last modified:	2024-09-27

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11 entries where MCM is covalently linked to polymer or other heterogen groups 11 entries where MCM is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	11

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Chemical Component Summary
Name	7-AMINO-4-METHYL-CHROMEN-2-ONE
Synonyms	7-AMINO-4-METHYLCOUMARIN
Systematic Name (OpenEye OEToolkits)	7-amino-4-methyl-chromen-2-one
Formula	C₁₀ H₉ N O₂
Molecular Weight	175.184
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C2Oc1cc(ccc1C(=C2)C)N
SMILES	CACTVS	3.341	CC1=CC(=O)Oc2cc(N)ccc12
SMILES	OpenEye OEToolkits	1.5.0	CC1=CC(=O)Oc2c1ccc(c2)N
Canonical SMILES	CACTVS	3.341	CC1=CC(=O)Oc2cc(N)ccc12
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC1=CC(=O)Oc2c1ccc(c2)N
InChI	InChI	1.03	InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3
InChIKey	InChI	1.03	GLNDAGDHSLMOKX-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08168
Name	Coumarin 120
Groups	experimental
Synonyms	7-Amino-4-methylcoumarin Coumarin 120
Categories	Benzopyrans Compounds used in a research, industrial, or household setting Heterocyclic Compounds, Fused-Ring Indicators and Reagents Laboratory Chemicals Pyrans
CAS number	26093-31-2

Drug Targets

Name	Target Sequence	Pharmacological Action
Peptidyl-prolyl cis-trans isomerase A	MFKSTLAAMAAVFALSALSPAAMAAKGDPHVLLTTSAGNIELELDKQKAP...	unknown
Peptidyl-prolyl cis-trans isomerase F, mitochondrial	MLALRCGSRWLGLLSVPRSVPLRLPAARACSKGSGDPSSSSSSGNPLVYL...	unknown
Histone deacetylase 8	MEEPEEPADSGQSLVPVYIYSPEYVSMCDSLAKIPKRASMVHSLIEAYAL...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682