InChI=1S/C63H96Cl2N18O13S/c1-35(2)31-45(57(91)76-41(53(70)87)25-30-97-3)75-52(86)34-74-54(88)46(32-36-13-17-38(64)18-14-36)80-58(92)47(33-37-15-19-39(65)20-16-37)81-56(90)42(21-23-50(68)84)77-55(89)43(22-24-51(69)85)78-59(93)49-12-8-29-83(49)62(96)44(10-4-5-26-66)79-60(94)48-11-7-28-82(48)61(95)40(67)9-6-27-73-63(71)72/h13-20,35,40-49H,4-12,21-34,66-67H2,1-3H3,(H2,68,84)(H2,69,85)(H2,70,87)(H,74,88)(H,75,86)(H,76,91)(H,77,89)(H,78,93)(H,79,94)(H,80,92)(H,81,90)(H4,71,72,73)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-/m0/s1

【InChIKey】

InChIKey=MYEKEWTXCRYGCH-CUZNLEPHSA-N

【SMILES】

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)Cl)NC(=O)[C@H](Cc2ccc(cc2)Cl)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCN)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCNC(=N)N)N

【MOL File】

ARG-PRO-LYS-PRO-GLN-….mol

2ChemicalProperties

【ComputedProperties】

pro_donors:16

pro_acceptors:31

XLogP3:-6.0

Bulk/Fine:F

3MaterialMSDS

4CMLFile

ARG-PRO-LYS-PRO-GLN-GLN-P-CHLORO-PHE-P-CHLORO-PHE-GLY-LEU-MET-NH2.cml

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73646-81-8 ARG-PRO-LYS-PRO-GLN-GLN-P-CHLORO-PHE-P-CHLORO-PHE-GLY-LEU-MET-NH2

1Identification

【Name】

【CAS】

【MDL】

【中文同义词】

【EnglishSynonyms】

【pro_formula】

【pro_molWeight】

【Inchi】