10-Oxo 7,8-Seco-docetaxel

cas: 177556-02-4 — see every product listed under this CAS number, including other names

10-Oxo 7,8-Seco-docetaxel (CAS 177556-02-4) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 2,5mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-O855810-10MG
cas177556-02-4
size10mg
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Available pack sizes

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TRC 10mg price on request
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TRC 5mg price on request

properties

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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

[(1S,2S,3R,4E,9S)-3-[(2R,3S)-3-acetyloxy-2-(2-hydroxyethyl)oxetan-3-yl]-1,5-dihydroxy-9-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4,8,11,11-tetramethyl-6-oxo-2-bicyclo[5.3.1]undeca-4,7-dienyl] benzoate (CAS 177556-02-4) is a chemical compound with the molecular formula C43H53NO14 and a molecular weight of 807.9 g/mol. IUPAC name: [(1S,2S,3R,4E,9S)-3-[(2R,3S)-3-acetyloxy-2-(2-hydroxyethyl)oxetan-3-yl]-1,5-dihydroxy-9-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4,8,11,11-tetramethyl-6-oxo-2-bicyclo[5.3.1]undeca-4,7-dienyl] benzoate. InChIKey: JGMTYKDRJDAHSS-YFOBEHBLSA-N.

Identity
Molecular formulaC43H53NO14
Molecular weight807.9 g/mol
IUPAC name[(1S,2S,3R,4E,9S)-3-[(2R,3S)-3-acetyloxy-2-(2-hydroxyethyl)oxetan-3-yl]-1,5-dihydroxy-9-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-4,8,11,11-tetramethyl-6-oxo-2-bicyclo[5.3.1]undeca-4,7-dienyl] benzoate
InChIKeyJGMTYKDRJDAHSS-YFOBEHBLSA-N
SMILESCC1=C2C(=O)/C(=C(\[C@H]([C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C3=CC=CC=C3)NC(=O)OC(C)(C)C)O)O)OC(=O)C4=CC=CC=C4)[C@@]5(CO[C@@H]5CCO)OC(=O)C)/C)/O

Computed by PubChem (NCBI)