<common-name>Pentixafor</common-name> <description>Pentixafor belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the formula C60H80N14O14. With an average molecular weight of 1,221 g/mol, Pentixafor is a heavy molecule.</description> <cas>1341207-62-2</cas> <pubchem-id>54575322</pubchem-id> <chemical-formula>C60H80N14O14</chemical-formula> <weight>1221.4</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">2026-05-14T20:50:53Z</created-at> <updated-at type="dateTime">2026-08-23T03:10:39Z</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>DB22075</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>CN1[C@H](CCCNC(=O)C2=CC=C(CNC(=O)CN3CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC3)C=C2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(=O)N[C@H](CC2=CC=C(O)C=C2)C1=O</moldb-smiles> <moldb-formula>C60H80N14O14</moldb-formula> 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nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM141569</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>2-[4,7-bis(carboxymethyl)-10-[2-[[4-[3-[(2R,5S,8S,14R)-5-[3-(diaminomethylideneamino)propyl]-14-[(4-hydroxyphenyl)methyl]-1-methyl-8-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propylcarbamoyl]phenyl]methylamino]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid</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">921</paper-count> <sync-id>CED0008862</sync-id> <structure-inchikey>OSUJVKAXNLHVRB-HUMWUIFSSA-N</structure-inchikey> <structure-fingerprint>480000000400004002080000000100000080000000000000410000000000001004004000004122020040000100000000400000000001080002000000200010000000000000000000000020000030002002000101008000000000000004000000000004001100000800000000012000600000002010000040000010000020010002000004000000180008022000000408000100000010000000000008000000000000000c000000000000000085000000000000000108000008000000000000000000000050000012000000000000000400000404000000000400220000023010001000000000001002048000000010580000000000000200000000000000000</structure-fingerprint> 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9:�:;�;<�<=h�=>h�>?h�?@h�@Ah�ABh�BCh�CDh�DEh�:F�FG(�FH HI�IJ�JK(�JL LM�MN�NO�OPh�PQh�QRh�RS RTh�TUh�MV�VW(�V� + h�E<h�UOh�)��C>h�B��,./79:FHIJLMV� ��*+ ��!"#()��=>CDE<�?@ABC>�PQRTUO��</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:52:36Z</structure-indexed-at> </compound>

145676 <common-name>Pentixafor</common-name> <description>Pentixafor belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the formula C60H80N14O14. With an average molecular weight of 1,221 g/mol, Pentixafor is a heavy molecule.</description> <cas>1341207-62-2</cas> <pubchem-id>54575322</pubchem-id> <chemical-formula>C60H80N14O14</chemical-formula> <weight>1221.4</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">2026-05-14T20:50:53Z</created-at> <updated-at type="dateTime">2026-08-23T03:10:39Z</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>DB22075</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>CN1[C@H](CCCNC(=O)C2=CC=C(CNC(=O)CN3CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC3)C=C2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(=O)N[C@H](CC2=CC=C(O)C=C2)C1=O</moldb-smiles> <moldb-formula>C60H80N14O14</moldb-formula> 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