HIV INTEGRASE PROTEIN INHIBITOR(1)

CAS No.
172546-75-7
CCD No.
CCD00165652
Formula
C46 H55 N11 O7 S
MolWeight
906.076

Basic Information

Product Name: HIV INTEGRASE PROTEIN INHIBITOR(1)
CAS: 172546-75-7
English Synonyms: HIV INTEGRASE PROTEIN INHITOR (I) ; HIV INTEGRASE PROTEIN INHIBITOR ; H-HIS-CYS-LYS-PHE-TRP-TRP-OH ; HIV INTEGRASE PROTEIN INHIBITOR(1) ; HIS-CYS-LYS-PHE-TRP-TRP ; HCKFWW
MDL Number.: MFCD00798733
H bond acceptor: 18
H bond donor: 11
Smile: c1ccc(cc1)C[C@@H](C(=O)N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N[C@@H](Cc4c[nH]c5c4cccc5)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](Cc6c[nH]cn6)N
InChi: InChI=1S/C46H55N11O7S/c47-17-9-8-16-36(53-45(62)40(25-65)57-41(58)33(48)21-30-24-49-26-52-30)42(59)54-37(18-27-10-2-1-3-11-27)43(60)55-38(19-28-22-50-34-14-6-4-12-31(28)34)44(61)56-39(46(63)64)20-29-23-51-35-15-7-5-13-32(29)35/h1-7,10-15,22-24,26,33,36-40,50-51,65H,8-9,16-21,25,47-48H2,(H,49,52)(H,53,62)(H,54,59)(H,55,60)(H,56,61)(H,57,58)(H,63,64)/t33-,36-,37-,38-,39-,40-/m0/s1
InChiKey: InChIKey=ITHDAFCBITUNSR-CCMAZBEPSA-N

Property

Safety information

WGK Germany: 3

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