(Glycyl(88,90))-Hcg-beta (82-101)
[CAS# 105028-22-6]

Identification

• Name: (Glycyl(88,90))-Hcg-beta (82-101)
• Synonyms: Hcg-Beta (Gly(88,90))82-101; Hcg-Beta, (Glycine(88,90))82-101-; (Gly(88,90)) Hcg-Beta (82-101)
• Molecular Formula: C₈₂H₁₃₅N₂₇O₂₉S₂
• Molecular Weight: 2027.25
• CAS Registry Number: 105028-22-6
• SMILES: [C@H](C(NCC(=O)O)=O)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC(CNC([C@@H](NC(CNC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CC13C(=C2C(O)(C=C1)S2)S3)=O)C)=O)C(C)C)=O)C)=O)CC(C)C)=O)CO)=O)=O)CCC(=O)N)=O)=O)C)=O)CC(C)C)=O)C)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)CO)=O)[C@@H](C)O)=O)[C@@H](C)O)=O)CC(=O)O)=O)C
• InChI: 1S/C82H135N27O29S2/c1-33(2)24-47(72(131)97-38(9)64(123)100-44(16-14-22-89-79(85)86)70(129)101-45(17-15-23-90-80(87)88)71(130)106-51(32-111)75(134)108-59(42(13)113)78(137)109-58(41(12)112)77(136)104-49(26-55(117)118)73(132)96-36(7)62(121)93-30-56(119)120)102-63(122)37(8)94-53(115)28-91-68(127)46(18-19-52(84)114)99-54(116)29-92-69(128)50(31-110)105-74(133)48(25-34(3)4)103-65(124)39(10)98-76(135)57(35(5)6)107-66(125)40(11)95-67(126)43(83)27-81-20-21-82(138)61(140-82)60(81)139-81/h20-21,33-51,57-59,110-113,138H,14-19,22-32,83H2,1-13H3,(H2,84,114)(H,91,127)(H,92,128)(H,93,121)(H,94,115)(H,95,126)(H,96,132)(H,97,131)(H,98,135)(H,99,116)(H,100,123)(H,101,129)(H,102,122)(H,103,124)(H,104,136)(H,105,133)(H,106,130)(H,107,125)(H,108,134)(H,109,137)(H,117,118)(H,119,120)(H4,85,86,89)(H4,87,88,90)/t36-,37-,38-,39-,40-,41+,42+,43-,44-,45-,46-,47-,48-,49-,50-,51-,57-,58-,59-,81?,82?/m0/s1
• InChIKey: ZFJLWWNEENUSKP-GUSHEPIUSA-N