UPEROLEIN ,55601-63-3 _Chemical Cloud Database

UPEROLEIN

Basic Information
Product Name：	UPEROLEIN
CAS：	55601-63-3
English Synonyms：	PGLU-PRO-ASP-PRO-ASN-ALA-PHE-TYR-GLY-LEU-MET-NH2 ; GLP-PRO-ASP-PRO-ASN-ALA-PHE-TYR-GLY-LEU-MET-NH2 ; UPEROLEIN
MDL Number.：	MFCD00080026
H bond acceptor：	29
H bond donor：	13
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)O)NC(=O)[C@@H]4CCCN4C(=O)[C@@H]5CCC(=O)N5
InChi：	InChI=1S/C57H79N13O16S/c1-30(2)24-37(52(81)64-35(48(59)77)20-23-87-4)63-46(74)29-60-50(79)38(26-33-14-16-34(71)17-15-33)66-53(82)39(25-32-10-6-5-7-11-32)65-49(78)31(3)61-51(80)40(27-44(58)72)67-54(83)42-12-9-22-70(42)57(86)41(28-47(75)76)68-55(84)43-13-8-21-69(43)56(85)36-18-19-45(73)62-36/h5-7,10-11,14-17,30-31,35-43,71H,8-9,12-13,18-29H2,1-4H3,(H2,58,72)(H2,59,77)(H,60,79)(H,61,80)(H,62,73)(H,63,74)(H,64,81)(H,65,78)(H,66,82)(H,67,83)(H,68,84)(H,75,76)/t31-,35-,36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
InChiKey：	InChIKey=JPOQNRWDXRZJDN-MFFBADCGSA-N

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