GP46 (145-158)

pro_cas
pro_cdbregno
CCD00118678
pro_formula
C69 H114 N22 O19 S
pro_molWeight
1587.86

basic_info

Product_Name: GP46 (145-158)
EnglishSynonyms: VAL-SER-ARG-LEU-ASN-ILE-ASN-LEU-HIS-PHE-SER-LYS-CYS-GLY ; GP46 (145-158)
pro_mdlNumber: MFCD00273978
pro_acceptors: 41
pro_donors: 24
pro_smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](C(C)C)N
InChi: InChI=1S/C69H114N22O19S/c1-9-37(8)55(91-64(106)47(27-52(72)95)86-60(102)42(22-34(2)3)82-57(99)41(19-15-21-77-69(74)75)81-66(108)49(31-93)89-67(109)54(73)36(6)7)68(110)87-46(26-51(71)94)63(105)83-43(23-35(4)5)59(101)85-45(25-39-28-76-33-79-39)62(104)84-44(24-38-16-11-10-12-17-38)61(103)88-48(30-92)65(107)80-40(18-13-14-20-70)58(100)90-50(32-111)56(98)78-29-53(96)97/h10-12,16-17,28,33-37,40-50,54-55,92-93,111H,9,13-15,18-27,29-32,70,73H2,1-8H3,(H2,71,94)(H2,72,95)(H,76,79)(H,78,98)(H,80,107)(H,81,108)(H,82,99)(H,83,105)(H,84,104)(H,85,101)(H,86,102)(H,87,110)(H,88,103)(H,89,109)(H,90,100)(H,91,106)(H,96,97)(H4,74,75,77)/t37-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,54-,55-/m0/s1
InChiKey: InChIKey=ADSCQCWQFLGANP-VNGOJPGNSA-N

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