Name: | NFF-3 |
CAS: | 158584-09-9 |
Synonyms: | MCA-RPKPVE-NVA-WR-K(DNP)-NH2 ; NFF-3 ; MOCAC-ARG-PRO-LYS-PRO-VAL-GLU-NVA-TRP-ARG-LYS(DNP)-NH2 ; MCA-ARG-PRO-LYS-PRO-VAL-GLU-NVAL-TRP-ARG-LYS(NDP)-NH2 ; MMP SUBSTRATE-2 ; MCA-ARG-PRO-LYS-PRO-VAL-GLU-NVA-TRP-ARG-LYS(DNP)-NH2 ; 7-METHOXYCOUMARIN-4-ACETYL-ARG-PRO-LYS-PRO-VAL-GLU-NVA-TRP-ARG-(2,4-DINITROPHENYL)LYS AMIDE |
MDL.: | MFCD00671420 |
H bond acceptor: | 42 |
H bond donor: | 19 |
Smile: | CCC[C@@H](C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCNc3ccc(cc3[N+](=O)[O-])[N+](=O)[O-])C(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCCN)NC(=O)[C@@H]5CCCN5C(=O)[C@H](CCCNC(=N)N)NC(=O)Cc6cc(=O)oc7c6ccc(c7)OC |
InChi: | 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 |
InChiKey: | InChIKey=TVZDWYYXHAIMCR-BKNSPTOHSA-N |
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Safety information |
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WGK Germany: | 3 |
NFF-3
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