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CHEBI:125509 - LSM-37015

ChEBI IDCHEBI:125509
ChEBI NameLSM-37015
Stars
DownloadsMolfile
FormulaC104H186N40O26
Net Charge0
Average Mass2412.886
Monoisotopic Mass2411.44620
SMILESCCCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCNC(C)=O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@]1(C)CCCC=CCCC[C@](C)(C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC1=O
InChIInChI=1S/C104H186N40O26/c1-13-15-28-62(130-86(160)67(35-38-73(105)146)136-94(168)78(56(7)14-2)142-88(162)64(32-25-47-124-100(114)115)132-83(157)61(30-23-45-122-98(110)111)129-75(148)41-50-120-59(10)145)85(159)138-71(52-55(5)6)90(164)139-70(51-54(3)4)89(163)135-68(36-39-76(149)150)82(156)128-57(8)80(154)127-58(9)81(155)137-72(53-74(106)147)91(165)134-66(34-27-49-126-102(118)119)93(167)144-104(12)43-21-19-17-16-18-20-42-103(11,95(169)140-60(79(107)153)29-22-44-121-97(108)109)143-92(166)65(33-26-48-125-101(116)117)133-84(158)63(31-24-46-123-99(112)113)131-87(161)69(141-96(104)170)37-40-77(151)152/h16-17,54-58,60-72,78H,13-15,18-53H2,1-12H3,(H2,105,146)(H2,106,147)(H2,107,153)(H,120,145)(H,127,154)(H,128,156)(H,129,148)(H,130,160)(H,131,161)(H,132,157)(H,133,158)(H,134,165)(H,135,163)(H,136,168)(H,137,155)(H,138,159)(H,139,164)(H,140,169)(H,141,170)(H,142,162)(H,143,166)(H,144,167)(H,149,150)(H,151,152)(H4,108,109,121)(H4,110,111,122)(H4,112,113,123)(H4,114,115,124)(H4,116,117,125)(H4,118,119,126)/t56-,57-,58-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,78-,103+,104+/m0/s1
InChIKeyCSGSLCIDEQTPMX-CANCTWNJSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
LSM-37015 (CHEBI:125509) is a polypeptide (CHEBI:15841)
Manual XrefsDatabases
LSM-37015LINCS