Products 1404071-37-9

CAS 1404071-37-9 appears in our catalog under these names: BAY 1135626, BAY 1135626, 99.19%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 1mg, 100 mg, 25 mg, 50 mg, 10mM/1mL, 1 mg, 10 mg, 5 mg.

BAY 1135626
GLPBio
  • size: 1mg
  • Variants: 1
from 4622.27
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BAY 1135626, 99.19%
MedChemExpress
  • size: 100 mg, 25 mg, 50 mg, 10mM/1mL
  • Variants: 7
from 1197.41
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Structural formula: {0} (CAS {1})

(2S)-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-2-[[(2S)-2-[[4-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoyl]hydrazinyl]-4-oxobutyl]-methylamino]-3-methylbutanoyl]amino]-N,3-dimethylbutanamide (CAS 1404071-37-9) is a chemical compound with the molecular formula C55H86N10O11 and a molecular weight of 1063.3 g/mol. IUPAC name: (2S)-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-2-[[(2S)-2-[[4-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoyl]hydrazinyl]-4-oxobutyl]-methylamino]-3-methylbutanoyl]amino]-N,3-dimethylbutanamide. InChIKey: WKLHCCJTASJGSQ-LYBNSWTHSA-N.

Identity
Molecular formulaC55H86N10O11
Molecular weight1063.3 g/mol
IUPAC name(2S)-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-2-[[(2S)-2-[[4-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoyl]hydrazinyl]-4-oxobutyl]-methylamino]-3-methylbutanoyl]amino]-N,3-dimethylbutanamide
InChIKeyWKLHCCJTASJGSQ-LYBNSWTHSA-N
SMILESCC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)N)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)CCCC(=O)NNC(=O)CCCCCN4C(=O)C=CC4=O

Computed by PubChem (NCBI)

Synonyms: orb2564848, WKLHCCJTASJGSQ-LYBNSWTHSA-N