Carvacrol | MMP-AC0135

	Compound Name :	Carvacrol
	Compound Class :	Terpenoids
	Synonyms :	CARVACROL; 5-Isopropyl-2-methylphenol; 499-75-2; Karvakrol; Isopropyl-o-cresol;
	Compound Extracted from :	Carvacrol is extracted / reported from 2 Plant(s) of Melghat Flora as below MH262: Euphorbia thymifolia L. ; MH418: Cyclospermum leptophyllum (Pers.) Sprague;

	Molecular Formula :	C10H14O
	Molecular Weight :	150.22
	InChi Key :	RECUKUPTGUEGMW-UHFFFAOYSA-N
	IUPAC :	2-methyl-5-propan-2-ylphenol
	InChi :	InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3
	Hydrogen Bond Donor count :	1
	Hydrogen Bond Acceptor count :	1
	Rotational Bond count :	1
	TPSA :	20.2
	LogP Value :	3.1

	Lipinski Rule of Five :	Yes
	Ghose Filter :	No
	Veber Filter :	Yes
	Muegge Filter :	No

	PubChem CID :	10364
	Drugbank ID :	-
	Super Natural :	000499752
	CTD :	C073316
	HIT :	-
	NCI-60 GI50 data :	-

	Reference(s) :	https://www.ncbi.nlm.nih.gov/pubmed/27838229

Compound_ID	Cell Lines	Cancer Type	IC50 Value	EC50 Value	ED50 Value	GI50 Value	References
MMP-AC0135	MCF-7	Breast	23.6±1.1M	-	-	-	19656204
MMP-AC0135	HeLa	Cervix	50±5.95 mg/L	-	-	-	17172819
MMP-AC0135	SiHa	Cervix	50±3.89 mg/L	-	-	-	Biology and Medicine,2011, Vol 3 (2): 307-312
MMP-AC0135	HL-60	Haematopoietic and Lymphoid tissue	42.32 µg/ml	-	-	-	20359874
MMP-AC0135	B16(F10)	Skin	120±15 µMol/L	-	-	-	9164984

Compound_ID	Target	Gene_Name	Gene_ID	Cancer	Cell_lines	IC50 Value	EC50 Value	ED50 Value	GI50 Value	Remarks	References
MMP-AC0135	ERK1/2	-	-	Hepatoma	Hep G2	-	-	-	-	the phosphorylation of ERK1/2 decreased significantly in a concentration-dependent manner with the treatment of carvacrol.	21938469

MMP-AC0135 : Carvacrol