CHYPSRLRRDPFRDSPLSSR

CAS No.
CCD No.
CCD01020568
Formula
C104 H165 N37 O30 S
MolWeight
2445.74

Basic Information

Product Name: CHYPSRLRRDPFRDSPLSSR
English Synonyms: H-CYS-HIS-TYR-PRO-SER-ARG-LEU-ARG-ARG-ASP-PRO-PHE-ARG-ASP-SER-PRO-LEU-SER-SER-ARG-OH ; HSPB8 (10-29) ; CHYPSRLRRDPFRDSPLSSR
MDL Number.: MFCD11113673
H bond acceptor: 67
H bond donor: 41
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H]4CCCN4C(=O)[C@H](Cc5ccc(cc5)O)NC(=O)[C@H](Cc6c[nH]cn6)NC(=O)[C@H](CS)N
InChi: InChI=1S/C104H165N37O30S/c1-52(2)38-64(129-82(153)61(20-10-32-119-102(110)111)126-90(161)73(48-144)137-95(166)77-25-14-35-139(77)96(167)69(41-55-26-28-57(146)29-27-55)133-88(159)67(42-56-45-116-51-122-56)128-80(151)58(105)50-172)85(156)124-59(18-8-30-117-100(106)107)81(152)123-62(21-11-33-120-103(112)113)84(155)134-70(44-79(149)150)97(168)140-36-13-23-75(140)94(165)132-66(40-54-16-6-5-7-17-54)87(158)125-60(19-9-31-118-101(108)109)83(154)130-68(43-78(147)148)89(160)138-74(49-145)98(169)141-37-15-24-76(141)93(164)131-65(39-53(3)4)86(157)135-72(47-143)92(163)136-71(46-142)91(162)127-63(99(170)171)22-12-34-121-104(114)115/h5-7,16-17,26-29,45,51-53,58-77,142-146,172H,8-15,18-25,30-44,46-50,105H2,1-4H3,(H,116,122)(H,123,152)(H,124,156)(H,125,158)(H,126,161)(H,127,162)(H,128,151)(H,129,153)(H,130,154)(H,131,164)(H,132,165)(H,133,159)(H,134,155)(H,135,157)(H,136,163)(H,137,166)(H,138,160)(H,147,148)(H,149,150)(H,170,171)(H4,106,107,117)(H4,108,109,118)(H4,110,111,119)(H4,112,113,120)(H4,114,115,121)/t58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77+/m0/s1
InChiKey: InChIKey=BAGNSMMPPFFTPD-FCOWZYBASA-N

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