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CAS 146478-74-2

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(2Z,4S)-4-(Acetyloxy)-N-[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(2R,3R,4S,6S)-4-(chloromethyl)tetrahydro-3,4,6-trihydroxy-6-methyl-2H-pyran-2-yl]-3-methyl-2,4-pentadien-1-yl]tetrahydro-2,5-dimethyl-2H-pyran-3-yl]-2-pentenamide

Description:
The chemical substance with the name "(2Z,4S)-4-(Acetyloxy)-N-[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(2R,3R,4S,6S)-4-(chloromethyl)tetrahydro-3,4,6-trihydroxy-6-methyl-2H-pyran-2-yl]-3-methyl-2,4-pentadien-1-yl]tetrahydro-2,5-dimethyl-2H-pyran-3-yl]-2-pentenamide" and CAS number "146478-74-2" is a complex organic compound characterized by multiple stereocenters and functional groups. It features an acetyloxy group, which indicates the presence of an ester functional group, and a pentenamide moiety, suggesting potential reactivity in amide formation. The structure includes several tetrahydropyran rings, which are cyclic ethers known for their stability and prevalence in natural products. The presence of chloromethyl and multiple hydroxyl groups indicates potential for hydrogen bonding and reactivity, making it a candidate for various chemical transformations. This compound's stereochemistry, particularly the specified configurations, suggests it may exhibit specific biological activity or interactions, which could be of interest in medicinal chemistry or pharmacology. Overall, its intricate structure and functional diversity highlight its potential applications in organic synthesis and drug development.
Formula:C27H42ClNO8
InChI:InChI=1S/C27H42ClNO8/c1-16(8-11-23-25(32)27(34,15-28)14-26(6,33)37-23)7-10-22-17(2)13-21(19(4)36-22)29-24(31)12-9-18(3)35-20(5)30/h7-9,11-12,17-19,21-23,25,32-34H,10,13-15H2,1-6H3,(H,29,31)/b11-8+,12-9-,16-7+/t17-,18-,19+,21+,22-,23+,25+,26-,27+/m0/s1
InChI key:InChIKey=RONUKPQOBQKEHX-QHYZBLTGSA-N
SMILES:C(=C/C(=C/C[C@H]1[C@@H](C)C[C@@H](NC(/C=C\[C@@H](OC(C)=O)C)=O)[C@@H](C)O1)/C)\[C@@H]2[C@@H](O)[C@@](CCl)(O)C[C@@](C)(O)O2
Synonyms:
  • WB 2663A
  • 2-Pentenamide, 4-(acetyloxy)-N-[6-[5-[4-(chloromethyl)tetrahydro-3,4,6-trihydroxy-6-methyl-2H-pyran-2-yl]-3-methyl-2,4-pentadienyl]tetrahydro-2,5-dimethyl-2H-pyran-3-yl]-, [2R-[2R*[1[2R*,3R*(2Z,4S*),5S*,6S*],2E,4E],3R*,4S*,6R*]]-
  • FR 901463
  • (2Z,4S)-4-(Acetyloxy)-N-[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(2R,3R,4S,6S)-4-(chloromethyl)tetrahydro-3,4,6-trihydroxy-6-methyl-2H-pyran-2-yl]-3-methyl-2,4-pentadien-1-yl]tetrahydro-2,5-dimethyl-2H-pyran-3-yl]-2-pentenamide
  • 2-Pentenamide, 4-(acetyloxy)-N-[(2R,3R,5S,6S)-6-[(2E,4E)-5-[(2R,3R,4S,6S)-4-(chloromethyl)tetrahydro-3,4,6-trihydroxy-6-methyl-2H-pyran-2-yl]-3-methyl-2,4-pentadien-1-yl]tetrahydro-2,5-dimethyl-2H-pyran-3-yl]-, (2Z,4S)-
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