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Home/Compounds/API/2-methyl-L-alanyl-N-[(3R,4S,5S)-3-methoxy-1-{(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino}propyl]pyrrolidin-1-yl}-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide
C39H62N6O6S
743 g/mol
API

Auristatin 0101

CAS1436391-86-4
Category
API
Compound Class
Peptide
Primary Use
Pharmaceutical Raw Material

Auristatin 0101 is a chemical compound used as a payload in antibody-drug conjugates (ADCs). It features a complex, flexible structure with multiple amide groups, aromatic rings, and ether linkages, and is designed for research and pharmaceutical manufacturing applications.

Antibody-drug conjugate payloadPharmaceutical raw material for ADC developmentResearch compound for targeted drug delivery studies

Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.

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StrongStructure SimilarSimilarity 0.86

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Identifiers
IUPAC Name

(2S)-2-[(2-amino-2-methylpropanoyl)amino]-N-[(3R,4S,5S)-3-methoxy-1-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-[[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino]propyl]pyrrolidin-1-yl]-5-methyl-1-oxoheptan-4-yl]-N,3-dimethylbutanamide

InChIKey

QAAFNSMAIAVCHE-BZLYQNAUSA-N

SMILES

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC=CS3)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)C(C)(C)N

Synonyms (8)
  • 3WD
  • Auristatin 0101