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Bioactive Small Molecules
Ligand families
Activin and Inhibin
calcium;(6aR,10S,10aR,11S,11aR,12R)-8-carbamoyl-10-(dimethylamino)-4,6a,7,11-tetrahydroxy-12-methyl-6,9-dioxo-10a,11,11a,12-tetrahydro-10H-tetracen-5-olate , Matrix metalloproteinase-1 inhibitor, CAS No.54694363, Matrix metalloproteinase-1 inhibitor

calcium;(6aR,10S,10aR,11S,11aR,12R)-8-carbamoyl-10-(dimethylamino)-4,6a,7,11-tetrahydroxy-12-methyl-6,9-dioxo-10a,11,11a,12-tetrahydro-10H-tetracen-5-olate , Matrix metalloproteinase-1 inhibitor, CAS No.54694363, Matrix metalloproteinase-1 inhibitor

Item Number

C671225

Grouped product items
SKU	Size	Availability	Price	Qty
C671225-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90

Basic Description

Synonyms	DOXYCYCLINE CALCIUM \| CHEMBL2364574
Action Type	INHIBITOR
Mechanism of action	Matrix metalloproteinase-1 inhibitor

IUPAC Name	calcium;(6aR,10S,10aR,11S,11aR,12R)-8-carbamoyl-10-(dimethylamino)-4,6a,7,11-tetrahydroxy-12-methyl-6,9-dioxo-10a,11,11a,12-tetrahydro-10H-tetracen-5-olate
INCHI	InChI=1S/2C22H24N2O8.Ca/c21-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h24-7,10,14-15,17,25-27,30,32H,1-3H3,(H2,23,31);/q;;+2/p-2/t2*7-,10+,14+,15-,17-,22-;/m00./s1
InChi Key	ZOZMOOILJMQCHS-YQCFNCLSSA-L
Canonical SMILES	CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)[O-])O)O)C(=O)N)N(C)C)O.CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)[O-])O)O)C(=O)N)N(C)C)O.[Ca+2]
Isomeric SMILES	C[C@@H]1[C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)[O-])O)O)C(=O)N)N(C)C)O.C[C@@H]1[C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)[O-])O)O)C(=O)N)N(C)C)O.[Ca+2]
PubChem CID	54694363
Molecular Weight	926.9

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