Description
CXCR4 antagonist 10 (compound 21) is a potent antagonist of CXCR4, with the IC50 of 7.8 nM. CXCR4 antagonist 10 plays an important role in cancer research.
Product information
CAS Number: 3056005-98-9
Molecular Weight: 975.06
Formula: C44H62N16O10
Chemical Name: (3S, 6S, 9S, 12S, 18S)-12-[(2S)-2-[(2S)-5-carbamimidamido-2-acetamidopentanamido]propanamido]-9-(3-carbamimidamidopropyl)-3-[(1H-imidazol-4-yl)methyl]-6-[(naphthalen-2-yl)methyl]-2, 5, 8, 11, 15-pentaoxo-1, 4, 7, 10, 14-pentaazacyclooctadecane-18-carboxylic acid
Smiles: CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C)C(=O)N[C@H]1CNC(=O)CC[C@H](NC(=O)[C@H](CC2=CNC=N2)NC(=O)[C@H](CC2=CC3=CC=CC=C3C=C2)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(O)=O
InChiKey: JGLIDMLRWIZBPG-NMYVUWQISA-N
InChi: InChI=1S/C44H62N16O10/c1-23(54-37(64)29(55-24(2)61)9-5-15-50-43(45)46)36(63)60-34-21-52-35(62)14-13-31(42(69)70)57-40(67)33(19-28-20-49-22-53-28)59-39(66)32(18-25-11-12-26-7-3-4-8-27(26)17-25)58-38(65)30(56-41(34)68)10-6-16-51-44(47)48/h3-4,7-8,11-12,17,20,22-23,29-34H,5-6,9-10,13-16,18-19,21H2,1-2H3,(H,49,53)(H,52,62)(H,54,64)(H,55,61)(H,56,68)(H,57,67)(H,58,65)(H,59,66)(H,60,63)(H,69,70)(H4,45,46,50)(H4,47,48,51)/t23-,29-,30-,31-,32-,33-,34-/m0/s1
Technical Data
Appearance: Solid Power
Purity: ≥98% (or refer to the Certificate of Analysis)
Solubility: To be determined
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical or refer to Certificate of Analysis
Storage Condition: Dry, dark and -20 oC for 1 year or refer to the Certificate of Analysis.
Shelf Life: ≥12 months if stored properly.
Stock Solution Storage: 0 - 4 oC for 1 month or refer to the Certificate of Analysis.
Drug Formulation: To be determined
HS Tariff Code: 382200
Products are for research use only. Not for human use.
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