Fusidic acid impurity 4

cas: 2802408-15-5 — see every product listed under this CAS number, including other names

Fusidic acid impurity 4 (CAS 2802408-15-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2802408-15-5
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Structural formula: {0} (CAS {1})

(E,2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-acetyloxy-3,11-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-7-hydroxy-6-methylhept-5-enoic acid (CAS 2802408-15-5) is a chemical compound with the molecular formula C31H48O7 and a molecular weight of 532.7 g/mol. IUPAC name: (E,2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-acetyloxy-3,11-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-7-hydroxy-6-methylhept-5-enoic acid. InChIKey: FLMRNAGUOJGEDM-CEDPPNKGSA-N.

Identity
Molecular formulaC31H48O7
Molecular weight532.7 g/mol
IUPAC name(E,2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-acetyloxy-3,11-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-7-hydroxy-6-methylhept-5-enoic acid
InChIKeyFLMRNAGUOJGEDM-CEDPPNKGSA-N
SMILESC[C@H]1[C@@H]2CC[C@]3([C@H]([C@]2(CC[C@H]1O)C)[C@@H](C[C@@H]\4[C@@]3(C[C@@H](/C4=C(/CC/C=C(\C)/CO)\C(=O)O)OC(=O)C)C)O)C

Computed by PubChem (NCBI)

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