Products 108212-76-6

CAS 108212-76-6 appears in our catalog under these names: N-Acetyl-Calicheamicin/ 99.59% (existing batch purity), N-Acetyl-Calicheamicin 99%, N-Acetyl-Calicheamicin, N-Acetyl-Calicheamicin, 99.94%. Offered by: TargetMol, Ambeed, Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 2mg, 5 mg, 1 mg.

N-Acetyl-Calicheamicin/ 99.59% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 5
from 3334.31
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N-Acetyl-Calicheamicin 99%
Ambeed
  • size: 1mg, 2mg, 5mg, 10mg
  • Variants: 5
from 1087.94
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N-Acetyl-Calicheamicin
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 4
from 4619.60
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N-Acetyl-Calicheamicin, 99.94%
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 2999.28
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Structural formula: {0} (CAS {1})

S-[(2R,3S,4S,6S)-6-[[(2R,3S,4S,5R,6R)-5-[(2S,4S,5S)-5-[acetyl(ethyl)amino]-4-methoxyoxan-2-yl]oxy-4-hydroxy-6-[[(2S,5Z,9R)-9-hydroxy-12-(methoxycarbonylamino)-13-[2-(methyltrisulfanyl)ethylidene]-11-oxo-2-bicyclo[7.3.1]trideca-1(12),5-dien-3,7-diynyl]oxy]-2-methyloxan-3-yl]amino]oxy-4-hydroxy-2-methyloxan-3-yl] 4-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioate (CAS 108212-76-6) is a chemical compound with the molecular formula C57H76IN3O22S4 and a molecular weight of 1410.4 g/mol. IUPAC name: S-[(2R,3S,4S,6S)-6-[[(2R,3S,4S,5R,6R)-5-[(2S,4S,5S)-5-[acetyl(ethyl)amino]-4-methoxyoxan-2-yl]oxy-4-hydroxy-6-[[(2S,5Z,9R)-9-hydroxy-12-(methoxycarbonylamino)-13-[2-(methyltrisulfanyl)ethylidene]-11-oxo-2-bicyclo[7.3.1]trideca-1(12),5-dien-3,7-diynyl]oxy]-2-methyloxan-3-yl]amino]oxy-4-hydroxy-2-methyloxan-3-yl] 4-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioate. InChIKey: WPDOZYZAJKUVRZ-NRYSMURASA-N.

Identity
Molecular formulaC57H76IN3O22S4
Molecular weight1410.4 g/mol
IUPAC nameS-[(2R,3S,4S,6S)-6-[[(2R,3S,4S,5R,6R)-5-[(2S,4S,5S)-5-[acetyl(ethyl)amino]-4-methoxyoxan-2-yl]oxy-4-hydroxy-6-[[(2S,5Z,9R)-9-hydroxy-12-(methoxycarbonylamino)-13-[2-(methyltrisulfanyl)ethylidene]-11-oxo-2-bicyclo[7.3.1]trideca-1(12),5-dien-3,7-diynyl]oxy]-2-methyloxan-3-yl]amino]oxy-4-hydroxy-2-methyloxan-3-yl] 4-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioate
InChIKeyWPDOZYZAJKUVRZ-NRYSMURASA-N
SMILESCCN([C@H]1CO[C@H](C[C@@H]1OC)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@H]3C#C/C=C\C#C[C@@]4(CC(=O)C(=C3C4=CCSSSC)NC(=O)OC)O)C)NO[C@H]5C[C@@H]([C@@H]([C@H](O5)C)SC(=O)C6=C(C(=C(C(=C6OC)OC)O[C@H]7[C@@H]([C@@H]([C@H]([C@@H](O7)C)O)OC)O)I)C)O)O)C(=O)C

Computed by PubChem (NCBI)

Synonyms: N-Acetyl calicheamicin, N-Acetylcalicheamicin gamma, N-Acetyl-gamma-calicheamicin, N-Acetyl LL-E33288gamma1I, N-ACETYLCALICHEAMICIN .GAMMA., N-ACETYL-.GAMMA.-CALICHEAMICIN