HIV-1 MN ENV-56

pro_cas
pro_cdbregno
CCD00416397
pro_formula
C72 H107 N19 O20 S2
pro_molWeight
1622.88

basic_info

Product_Name: HIV-1 MN ENV-56
EnglishSynonyms: HIV-1 MN ENV-56 ; H-HIS-TYR-CYS-ALA-PRO-ALA-GLY-PHE-ALA-ILE-LEU-LYS-CYS-ASN-ASP-OH ; HYCAPAGFAILKCND
pro_mdlNumber: MFCD03790331
pro_acceptors: 39
pro_donors: 20
pro_smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@H](Cc4c[nH]cn4)N
InChi: InChI=1S/C72H107N19O20S2/c1-8-37(4)58(70(108)86-47(25-36(2)3)64(102)83-46(17-12-13-23-73)62(100)88-53(34-113)68(106)85-50(29-55(75)93)66(104)87-51(72(110)111)30-57(95)96)90-60(98)39(6)79-63(101)48(26-41-15-10-9-11-16-41)82-56(94)32-77-59(97)38(5)80-69(107)54-18-14-24-91(54)71(109)40(7)81-67(105)52(33-112)89-65(103)49(27-42-19-21-44(92)22-20-42)84-61(99)45(74)28-43-31-76-35-78-43/h9-11,15-16,19-22,31,35-40,45-54,58,92,112-113H,8,12-14,17-18,23-30,32-34,73-74H2,1-7H3,(H2,75,93)(H,76,78)(H,77,97)(H,79,101)(H,80,107)(H,81,105)(H,82,94)(H,83,102)(H,84,99)(H,85,106)(H,86,108)(H,87,104)(H,88,100)(H,89,103)(H,90,98)(H,95,96)(H,110,111)/t37-,38-,39-,40-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,58-/m0/s1
InChiKey: InChIKey=MJXAPFVFBBGQSC-JDJYFHKASA-N

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