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Merck
CN

M9545

7-Methoxycoumarin-4-acetyl-Arg-Pro-Lys-Pro-Val-Glu-Nva-Trp-Arg-(2,4-dinitrophenyl)Lys amide

≥97% (HPLC)

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About This Item

Empirical Formula (Hill Notation):
C78H110N22O20
CAS Number:
Molecular Weight:
1675.84
UNSPSC Code:
12352204
PubChem Substance ID:
MDL number:
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assay

≥97% (HPLC)

form

powder

solubility

0.05 M acetic acid: 1 mg/mL, clear, yellow

UniProt accession no.

storage temp.

−20°C

SMILES string

CCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC(=O)CC3=CC(=O)Oc4cc(OC)ccc34)C(C)C)C(=O)N[C@@H](Cc5c[nH]c6ccccc56)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNc7ccc(cc7[N+]([O-])=O)[N+]([O-])=O)C(N)=O

InChI

1S/C78H110N22O20/c1-5-16-53(68(106)95-58(37-45-42-88-50-18-7-6-17-48(45)50)71(109)92-54(21-12-33-86-77(81)82)69(107)90-52(67(80)105)19-9-11-32-85-51-28-25-46(99(115)116)40-61(51)100(117)118)91-70(108)55(29-30-64(102)103)93-74(112)66(43(2)3)96-73(111)60-24-15-36-98(60)76(114)57(20-8-10-31-79)94-72(110)59-23-14-35-97(59)75(113)56(22-13-34-87-78(83)84)89-63(101)38-44-39-65(104)120-62-41-47(119-4)26-27-49(44)62/h6-7,17-18,25-28,39-43,52-60,66,85,88H,5,8-16,19-24,29-38,79H2,1-4H3,(H2,80,105)(H,89,101)(H,90,107)(H,91,108)(H,92,109)(H,93,112)(H,94,110)(H,95,106)(H,96,111)(H,102,103)(H4,81,82,86)(H4,83,84,87)/t52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1

InChI key

TVZDWYYXHAIMCR-BKNSPTOHSA-N

Gene Information

mouse ... Nppa(230899)

Application

Substrate for matrix metalloproteinases 3 and 9.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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H Nagase et al.
The Journal of biological chemistry, 269(33), 20952-20957 (1994-08-19)
Members of the matrix metalloproteinase (MMP) family have been implicated in disease states such as arthritis, periodontal disease, and tumor cell invasion and metastasis. Stromelysin 1 (MMP-3) has a broad substrate specificity and participates in the activation of several MMP

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