CATESTATIN, CHROMOGRANIN A (352-372), HUMAN

CAS No.
CCD No.
CCD01020526
Formula
C98 H153 N31 O26 S
MolWeight
2213.54

Basic Information

Product Name: CATESTATIN, CHROMOGRANIN A (352-372), HUMAN
English Synonyms: CATESTATIN, CHROMOGRANIN A (352-372), HUMAN ; H-SER-SER-MET-LYS-LEU-SER-PHE-ARG-ALA-ARG-ALA-TYR-GLY-PHE-ARG-GLY-PRO-GLY-PRO-GLN-OH ; SSMKLSFRARAYGFRGPGPQ
MDL Number.: MFCD11113630
H bond acceptor: 57
H bond donor: 34
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N4CCC[C@H]4C(=O)NCC(=O)N5CCC[C@H]5C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CO)N
InChi: InChI=1S/C98H153N31O26S/c1-53(2)43-67(124-86(145)62(23-12-13-36-99)119-87(146)65(35-42-156-5)121-91(150)71(51-131)126-81(140)60(100)50-130)88(147)127-72(52-132)92(151)125-70(45-57-21-10-7-11-22-57)90(149)120-64(26-16-39-110-98(106)107)85(144)114-54(3)79(138)117-63(25-15-38-109-97(104)105)84(143)115-55(4)80(139)123-68(46-58-29-31-59(133)32-30-58)83(142)111-47-76(135)116-69(44-56-19-8-6-9-20-56)89(148)118-61(24-14-37-108-96(102)103)82(141)112-48-77(136)128-40-17-27-73(128)93(152)113-49-78(137)129-41-18-28-74(129)94(153)122-66(95(154)155)33-34-75(101)134/h6-11,19-22,29-32,53-55,60-74,130-133H,12-18,23-28,33-52,99-100H2,1-5H3,(H2,101,134)(H,111,142)(H,112,141)(H,113,152)(H,114,144)(H,115,143)(H,116,135)(H,117,138)(H,118,148)(H,119,146)(H,120,149)(H,121,150)(H,122,153)(H,123,139)(H,124,145)(H,125,151)(H,126,140)(H,127,147)(H,154,155)(H4,102,103,108)(H4,104,105,109)(H4,106,107,110)/t54-,55-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-/m0/s1
InChiKey: InChIKey=QHKBBRQJZZRYNM-OERRQLBQSA-N

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