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CAS 62820-11-5

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2-Propenoic acid, 3-phenyl-, (1aS,1bR,2S,3S,4aR,6E,7aR,8aS,10aR)-1a,1b,2,3,4,5,7a,8,8a,9,10,10a-dodecahydro-2-hydroxy-6-(hydroxymethyl)-3,8,8,10a-tetramethyl-5-oxo-4aH-cyclopenta[3,4]cyclopropa[8,9]cycloundec[1,2-b]oxiren-4a-yl ester, (2E)-

Description:
The chemical substance known as 2-Propenoic acid, 3-phenyl-, with the CAS number 62820-11-5, is a complex organic compound characterized by its unique structural features. It contains a propenoic acid moiety, which is indicative of its potential reactivity and ability to participate in various chemical reactions, particularly polymerization. The presence of multiple stereocenters in its structure suggests that it may exist in different stereoisomeric forms, which can influence its physical and chemical properties, including solubility, boiling point, and reactivity. Additionally, the compound features a cyclopenta-cyclopropane framework, which may contribute to its rigidity and stability. The hydroxymethyl and hydroxy groups present in the structure can enhance its polarity and potential for hydrogen bonding, affecting its interactions with other molecules. Overall, this compound's intricate structure and functional groups suggest it may have applications in fields such as materials science, pharmaceuticals, or organic synthesis, although specific applications would depend on further research and characterization.
Formula:C29H36O6
InChI:InChI=1S/C29H36O6/c1-17-15-29(34-22(31)11-10-18-8-6-5-7-9-18)23(24(17)32)26-28(4,35-26)13-12-20-21(27(20,2)3)14-19(16-30)25(29)33/h5-11,14,17,20-21,23-24,26,30,32H,12-13,15-16H2,1-4H3
InChI key:InChIKey=ZLHWPIKKGZWBKR-UHFFFAOYSA-N
SMILES:O(C(C=CC1=CC=CC=C1)=O)C23C(C4C(C)(O4)CCC5C(C=C(CO)C2=O)C5(C)C)C(O)C(C)C3
Synonyms:
  • 2-Propenoic acid, 3-phenyl-, (1aS,1bR,2S,3S,4aR,6E,7aR,8aS,10aR)-1a,1b,2,3,4,5,7a,8,8a,9,10,10a-dodecahydro-2-hydroxy-6-(hydroxymethyl)-3,8,8,10a-tetramethyl-5-oxo-4aH-cyclopenta[3,4]cyclopropa[8,9]cycloundec[1,2-b]oxiren-4a-yl ester, (2E)-
  • 2-Propenoic acid, 3-phenyl-, 1a,1b,2,3,4,5,7a,8,8a,9,10,10a-dodecahydro-2-hydroxy-6-(hydroxymethyl)-3,8,8,10a-tetramethyl-5-oxo-4aH-cyclopenta[3,4]cyclopropa[8,9]cycloundec[1,2-b]oxiren-4a-yl ester, [1aS-[1aR*,1bS*,2R*,3R*,4aS*(E),6E,7aS*,8aR*,10aS*]]-
  • Jolkinol A
  • 4aH-Cyclopenta[3,4]cyclopropa[8,9]cycloundec[1,2-b]oxirene, 2-propenoic acid deriv.
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