133550 <common-name>CTCE-9908</common-name> <description>CTCE-9908 is an organic compound with the formula C86H147N27O23. CTCE-9908 belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. With an average molecular weight of 1,927 g/mol, CTCE-9908 is a heavy molecule. This compound has been found in or released from one recorded source: antennas within electrical and electronic equipment. In terms of biological activity, CTCE-9908 acts as a modulator of the protein target C-X-C chemokine receptor type 4 (CXCR4).</description> <cas>1030384-98-5</cas> <pubchem-id>16186350</pubchem-id> <chemical-formula>C86H147N27O23</chemical-formula> <weight>1927.3</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-14T15:46:08Z</created-at> <updated-at type="dateTime">2026-09-01T12:01:59Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id>DB05625</drugbank-id> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(C)C)C(N)=O</moldb-smiles> <moldb-formula>C86H147N27O23</moldb-formula> <moldb-inchi>InChI=1S/C86H147N27O23/c1-45(2)35-58(104-81(133)64(43-116)110-83(135)68(47(5)6)112-66(120)39-99-71(123)53(89)17-9-12-30-87)75(127)108-62(41-114)79(131)106-60(37-49-22-26-51(118)27-23-49)77(129)102-56(20-15-33-97-85(92)93)73(125)96-32-14-11-19-55(70(91)122)101-74(126)57(21-16-34-98-86(94)95)103-78(130)61(38-50-24-28-52(119)29-25-50)107-80(132)63(42-115)109-76(128)59(36-46(3)4)105-82(134)65(44-117)111-84(136)69(48(7)8)113-67(121)40-100-72(124)54(90)18-10-13-31-88/h22-29,45-48,53-65,68-69,114-119H,9-21,30-44,87-90H2,1-8H3,(H2,91,122)(H,96,125)(H,99,123)(H,100,124)(H,101,126)(H,102,129)(H,103,130)(H,104,133)(H,105,134)(H,106,131)(H,107,132)(H,108,127)(H,109,128)(H,110,135)(H,111,136)(H,112,120)(H,113,121)(H4,92,93,97)(H4,94,95,98)/t53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,68-,69-/m0/s1</moldb-inchi> <moldb-inchikey>VUYRSKROGTWHDC-HZGLMRDYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">1927.288</moldb-average-mass> <moldb-mono-mass type="decimal">1926.116314101</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-11</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM129443</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>(2S)-2,6-bis[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{2-[(2S)-2,6-diaminohexanamido]acetamido}-3-methylbutanamido]-3-hydroxypropanamido]-4-methylpentanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]pentanamido]hexanamide</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer">301</paper-count> <sync-id>CED0013256</sync-id> <structure-inchikey>VUYRSKROGTWHDC-HZGLMRDYSA-N</structure-inchikey> <structure-fingerprint>40000000404000000001c00000000400000801000004000004000002000000000000001000000200000000000000000000000008000000000000000020000010000000000000000400008000000100000020001000800000080102009040010000002000010000000000404000000002000000000000000000000500000001200000000040000020000082020000000080001000000000080000000000000000100000004000000000000000080040000000000080100800002000000004000000000000010000002000a00000200000000000000000100000000220000420000000000000008140000048000000010400000000000000000000020080010000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAACIAAAAiQAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBgBgAAAAAgIGIDQAAAACAQQHAGgAAAADAgEGACgAAAADBAgA KAAAAAMCBiA0AAAAAgEEBgBgAAAAAgIIAGAAAAABAQcAaAAAAAMCAQYAKAAA AAMECAAoAAAAAwIGIDQAAAABAQQHAGgAAAADAgEGACgAAAADBAgAKAAAAAMC BgBgAAAAAgIHAGgAAAADAgEGACgAAAADBAgAKAAAAAMCBiA0AAAAAQEEBwBg AAAAAQIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgcAYAAAAAEC BgBgAAAAAwEGAGAAAAABAwYAYAAAAAEDBgAoAAAAAwQIACgAAAADAgcAaAAA AAMCAQYgNAAAAAEBBAYAYAAAAAICCABgAAAAAQEGACgAAAADBAgAKAAAAAMC BwBoAAAAAwIBBiA0AAAAAQEEBgBgAAAAAgIGQCgAAAADBAZAaAAAAAMDAQZA aAAAAAMDAQZAKAAAAAMECABoAAAAAwEBBkBoAAAAAwMBBkBoAAAAAwMBBgAo AAAAAwQIACgAAAADAgcAaAAAAAMCAQYgNAAAAAEBBAYAYAAAAAICBgBgAAAA AgIGAGAAAAACAgcAaAAAAAMCAQYAKAAAAAMEBwBoAAAAAwECBwBoAAAAAwIB BgAoAAAAAwQIACgAAAADAgcAaAAAAAMCAQYAYAAAAAICBgBgAAAAAgIGAGAA AAACAgYAYAAAAAICBiA0AAAAAgEEBwBoAAAAAwIBBgAoAAAAAwQIACgAAAAD AgYgNAAAAAIBBAYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgcAaAAAAAMCAQYA KAAAAAMEBwBoAAAAAwECBwBoAAAAAwIBBwBoAAAAAwIBBgAoAAAAAwQIACgA AAADAgYgNAAAAAIBBAYAYAAAAAICBkAoAAAAAwQGQGgAAAADAwEGQGgAAAAD AwEGQCgAAAADBAgAaAAAAAMBAQZAaAAAAAMDAQZAaAAAAAMDAQcAaAAAAAMC AQYAKAAAAAMECAAoAAAAAwIGIDQAAAACAQQGAGAAAAACAggAYAAAAAEBBwBo AAAAAwIBBgAoAAAAAwQIACgAAAADAgYgNAAAAAIBBAYAYAAAAAICBgBgAAAA AwEGAGAAAAABAwYAYAAAAAEDBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYg NAAAAAIBBAYAYAAAAAICCABgAAAAAQEHAGgAAAADAgEGACgAAAADBAgAKAAA AAMCBiA0AAAAAQEEBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYAYAAAAAIC BwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYgNAAAAAEBBAcAYAAAAAECBgBg AAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIHAGAAAAABAgYAYAAAAAMB BgBgAAAAAQMGAGAAAAABAwYAKAAAAAMEBwBoAAAAAwECCAAoAAAAAwILAAEA AQIAAQMAAwQABAUABQYgBgcoAgYIAAgJAAkKAAgLAAsMIAwNKAIMDgAODwAP ECAQESgCEBIAEhMAExQgFBUoAhQWABYXABYYABgZABkaABobABscAA4dAB0e AB0fAAQgACAhKAIgIiAiIwAjJAAkJQAjJgAmJygCJiggKCkAKSoAKisAKyxo DCwtaAwtLmgMLi8gLjBoDDAxaAwpMgAyMygCMjQgNDUANTYANjcANzgAODkA OTogOjsgOjwoAjU9AD0+KAI9PyA/QABAQQBBQgBCQwBDRABERQBFRiBGRygC RkgASEkASUoASksAS0wATE0gTU4gTU8oAkhQAFBRIFFSKAJRUwBTVABUVQBV VmgMVldoDFdYaAxYWSBYWmgMWltoDFNcAFxdIF1eKAJdXwBfYABgYQBfYgBi YyBjZCgCY2UAZWYAZmcAZ2gAZ2kAZWoAamsga2woAmttAG1uAG5vAG1wAHBx IHFyKAJxcwBzdAB0dSB1digCdXcAd3gAeHkgeXooAnl7AHt8AHt9AH1+AH5/ AH+AAICBAHOCAIKDAIKEAESFAIWGIIWHKAIxK2gMW1VoDEICAAAABiwtLjAx KwZWV1haW1UXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:49:14Z</structure-indexed-at> </compound>