Menin-MLL inhibitor 31

Catalog No. :
ACMPKM244
CAS No. :
2863656-86-2
Molecular Formula :
C77H119FN28O14
Molecular Weight :
1679.98

IUPAC Name:(R)-1-((6'S,11'S,14'S,19a'S)-11'-((S)-2-((S)-2-((S)-2-acetamidopropanamido)-5-guanidinopentanamido)-3-(1H-indol-3-yl)propanamido)-14'-(3-fluorobenzyl)-1',4',12',15'-tetraoxooctadecahydrospiro[cyclobutane-1,3'-pyrrolo[1,2-d][1,4,7,10]tetraazacycloheptadecine]-6'-carbonyl)-N-((6S,9S,12S,15S)-1,18-diamino-6-carbamoyl-9,12-bis(3-guanidinopropyl)-1-imino-8,11,14-trioxo-2,7,10,13-tetraazaoctadecan-15-yl)pyrrolidine-3-carboxamide

Menin-MLL inhibitor 31 structure diagram
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Product Information

Product NameMenin-MLL inhibitor 31
IUPAC Name(R)-1-((6'S,11'S,14'S,19a'S)-11'-((S)-2-((S)-2-((S)-2-acetamidopropanamido)-5-guanidinopentanamido)-3-(1H-indol-3-yl)propanamido)-14'-(3-fluorobenzyl)-1',4',12',15'-tetraoxooctadecahydrospiro[cyclobutane-1,3'-pyrrolo[1,2-d][1,4,7,10]tetraazacycloheptadecine]-6'-carbonyl)-N-((6S,9S,12S,15S)-1,18-diamino-6-carbamoyl-9,12-bis(3-guanidinopropyl)-1-imino-8,11,14-trioxo-2,7,10,13-tetraazaoctadecan-15-yl)pyrrolidine-3-carboxamide
Molecular FormulaC77H119FN28O14
Molecular Weight1679.98
SMILESCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)N[C@H]1CCCC[C@@H](C(=O)N2CC[C@@H](C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C2)NC(=O)C2(CCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC2=CC=CC(F)=C2)NC1=O
InChI KeyQHHOXGNGWIOSPN-DWBGUCGJSA-N
SynonymAc-Ala-Arg-Trp-Gly(Allyl)-Phe(3-F)-Pro-(1-amino-1-cyclobutane carboxylic acid)- Gly(Allyl)-(R-3-Pyrrolidinecarboxylic acid)-Orn-Arg-Arg-Arg-NH2(Gly(Allyl)& Gly(Allyl) bridge);Menin-MLL inhibitor 31
CAS No.2863656-86-2

Synthetic Route by SureRoute

1. ACMPKM244 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACMPKM244 route product structure diagram
    ACMPKM2442863656-86-2
Inquiry

2. ACMPKM244 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACMPKM244 route product structure diagram
    ACMPKM2442863656-86-2
Inquiry

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