Products 842166-42-1

CAS 842166-42-1 appears in our catalog under these names: FC131 TFA (606968-52-9 free base)/ 99.67% (existing batch purity), FC131 (TFA), 99.87%, FC131 (TFA). Offered by: TargetMol, MedChemExpress, Chemat. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 5 mg, 10 mg.

FC131 TFA (606968-52-9 free base)/ 99.67% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 6
from 499.07
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FC131 (TFA), 99.87%
MedChemExpress
  • size: 5 mg, 10 mg
  • Variants: 2
from 839.82
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FC131 (TFA)
Chemat
  • size: 1mg, 2mg, 5mg, 10mg
  • Variants: 7
from 395.60
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Structural formula: {0} (CAS {1})

2-[3-[(2S,5S,8S,14R)-5-[3-(diaminomethylideneamino)propyl]-14-[(4-hydroxyphenyl)methyl]-8-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine;2,2,2-trifluoroacetic acid (CAS 842166-42-1) is a chemical compound with the molecular formula C38H48F3N11O8 and a molecular weight of 843.9 g/mol. IUPAC name: 2-[3-[(2S,5S,8S,14R)-5-[3-(diaminomethylideneamino)propyl]-14-[(4-hydroxyphenyl)methyl]-8-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine;2,2,2-trifluoroacetic acid. InChIKey: CJRFPYRTUCUEQI-UVHONZKJSA-N.

Identity
Molecular formulaC38H48F3N11O8
Molecular weight843.9 g/mol
IUPAC name2-[3-[(2S,5S,8S,14R)-5-[3-(diaminomethylideneamino)propyl]-14-[(4-hydroxyphenyl)methyl]-8-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine;2,2,2-trifluoroacetic acid
InChIKeyCJRFPYRTUCUEQI-UVHONZKJSA-N
SMILESC1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC3=CC=CC=C3C=C2)CCCN=C(N)N)CCCN=C(N)N)CC4=CC=C(C=C4)O.C(=O)(C(F)(F)F)O

Computed by PubChem (NCBI)

Synonyms: orb1219674, orb1296645