GP120-W61D-62

pro_cas
pro_cdbregno
CCD00416168
pro_formula
C62 H106 N20 O22 S2
pro_molWeight
1547.77

basic_info

Product_Name: GP120-W61D-62
EnglishSynonyms: KGLCTNVSTVQCTHG ; GP120-W61D-62 ; H-LYS-GLY-LEU-CYS-THR-ASN-VAL-SER-THR-VAL-GLN-CYS-THR-HIS-GLY-OH
pro_mdlNumber: MFCD03790099
pro_acceptors: 42
pro_donors: 24
pro_smile: CC(C)C[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)N
InChi: InChI=1S/C62H106N20O22S2/c1-26(2)16-35(71-43(89)20-68-50(92)33(64)12-10-11-15-63)53(95)77-40(24-106)57(99)82-48(30(8)85)61(103)74-37(18-42(66)88)54(96)78-45(27(3)4)59(101)75-38(22-83)55(97)80-49(31(9)86)62(104)79-46(28(5)6)58(100)72-34(13-14-41(65)87)52(94)76-39(23-105)56(98)81-47(29(7)84)60(102)73-36(17-32-19-67-25-70-32)51(93)69-21-44(90)91/h19,25-31,33-40,45-49,83-86,105-106H,10-18,20-24,63-64H2,1-9H3,(H2,65,87)(H2,66,88)(H,67,70)(H,68,92)(H,69,93)(H,71,89)(H,72,100)(H,73,102)(H,74,103)(H,75,101)(H,76,94)(H,77,95)(H,78,96)(H,79,104)(H,80,97)(H,81,98)(H,82,99)(H,90,91)/t29-,30-,31-,33+,34+,35+,36+,37+,38+,39+,40+,45+,46+,47+,48+,49+/m1/s1
InChiKey: InChIKey=JECMFRDZOUWAOI-MKVCOPSTSA-N

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