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CAS 92508-09-3

:

(1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-7,8,9,13-Tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-3aH-6,13a-epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one

Description:
The chemical substance with the name "(1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-7,8,9,13-Tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-3aH-6,13a-epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one" and CAS number "92508-09-3" is a complex organic compound characterized by its intricate stereochemistry and multiple functional groups. It features a chlorinated dodecahydro structure, indicating a saturated cyclic framework with multiple fused rings. The presence of acetyloxy groups suggests it has potential reactivity and solubility characteristics typical of esters. The compound's epoxy and methylene groups contribute to its structural diversity and may influence its biological activity. The specific stereochemistry, denoted by the R and S configurations, indicates the spatial arrangement of atoms, which is crucial for understanding its interactions in biological systems. Overall, this compound's unique structure may confer specific properties that could be of interest in medicinal chemistry or materials science.
Formula:C28H35ClO11
InChI:InChI=1/C28H35ClO11/c1-11-9-10-18(35-14(4)30)27(8)19(11)23(37-16(6)32)28-13(3)26(34)39-24(28)20(29)12(2)21(40-28)22(36-15(5)31)25(27)38-17(7)33/h13,18-25H,1-2,9-10H2,3-8H3/t13-,18-,19+,20-,21+,22+,23-,24-,25-,27-,28?/m0/s1
InChI key:InChIKey=PXWWTSQKNXBHTK-VQNAIMPISA-N
SMILES:O(C(C)=O)[C@@H]1[C@]23[C@]([C@@H](Cl)C(=C)[C@](O2)([C@H](OC(C)=O)[C@H](OC(C)=O)[C@]4(C)[C@@]1(C(=C)CC[C@@H]4OC(C)=O)[H])[H])(OC(=O)[C@@H]3C)[H]
Synonyms:
  • (1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-7,8,9,13-Tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-3aH-6,13a-epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one
  • 5H-6,13a-Epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one, 7,8,9,13-tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-, (1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-
  • 5H-6,13a-Epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one, 7,8,9,13-tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-, [1R-(1α,3aβ,4α,6α,7β,8β,8aβ,9α,12aα,13β,13aα)]-
  • Junceellin
  • 3aH-6,13a-Epoxybenzo[4,5]cyclodeca[1,2-b]furan-2(1H)-one, 7,8,9,13-tetrakis(acetyloxy)-4-chlorododecahydro-1,8a-dimethyl-5,12-bis(methylene)-, (1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-
  • See more synonyms
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