Chemical Compound

N-desmethylpretubulysin D

N-desmethylpretubulysin D chemical structure
Primary Record

N-desmethylpretubulysin D

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
139584394
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@H](CCC1=NC(=CS1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C[C@H](C)C(=O)O)C(C)C)NC(=O)[C@H]3CCCCN3C
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H]1CCCCN1C)C(=O)N[C@H](CCc1nc(C(=O)N[C@@H](Cc2ccc(O)cc2)C[C@H](C)C(=O)O)cs1)C(C)C

Names & Synonyms

  • N-desmethylpretubulysin D
  • RefChem:163243
  • CHEMBL5199536
  • CHEBI:201934
  • (2S,4R)-5-(4-hydroxyphenyl)-2-methyl-4-[[2-[(3R)-4-methyl-3-[[(2S,3S)-3-methyl-2-[[(2R)-1-methylpiperidine-2-carbonyl]amino]pentanoyl]amino]pentyl]-1,3-thiazole-4-carbonyl]amino]pentanoic acid
  • (2S,4R)-4-((hydroxy((2-((3R)-3-(((2S,3S)-1-hydroxy-2-((hydroxy((2R)-1-methylpiperidin-2-yl)methylidene)amino)-3-methylpentylidene)amino)-4-methylpentyl)-1,3-thiazol-4-yl))methylidene)amino)-5-(4-hydroxyphenyl)-2-methylpentanoate
  • (2S,4R)-4-{[hydroxy({2-[(3R)-3-{[(2S,3S)-1-hydroxy-2-({hydroxy[(2R)-1-methylpiperidin-2-yl]methylidene}amino)-3-methylpentylidene]amino}-4-methylpentyl]-1,3-thiazol-4-yl})methylidene]amino}-5-(4-hydroxyphenyl)-2-methylpentanoate
  • (2S,4R)-5-(4-hydroxyphenyl)-2-methyl-4-((2-((3R)-4-methyl-3-(((2S,3S)-3-methyl-2-(((2R)-1-methylpiperidine-2-carbonyl)amino)pentanoyl)amino)pentyl)-1,3-thiazole-4-carbonyl)amino)pentanoic acid