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CAS 197649-67-5

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2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-

Description:
The chemical substance known as "2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-" with CAS number 197649-67-5 is a complex organic compound characterized by its polycyclic structure, which includes a phenanthrene core. This compound features multiple functional groups, including hydroxyl (-OH) and methoxy (-OCH3) groups, contributing to its potential reactivity and biological activity. The presence of an epoxide group suggests that it may participate in various chemical reactions, including nucleophilic attacks. Its stereochemistry is defined by specific chiral centers, which can influence its pharmacological properties and interactions with biological systems. Such compounds are often studied for their potential therapeutic applications, particularly in fields like medicinal chemistry and pharmacology. The intricate arrangement of its substituents may also affect its solubility, stability, and overall behavior in different environments.
Formula:C21H28O6
InChI:InChI=1S/C21H28O6/c1-9(2)10-13(22)11-12(15(24)14(10)23)21-8-6-7-20(3,4)18(21)17(16(11)26-5)27-19(21)25/h9,16-18,22-24H,6-8H2,1-5H3/t16-,17+,18-,21?/m0/s1
InChI key:InChIKey=LBJNLIBZUVWVTE-YQMJFVBQSA-N
SMILES:O=C1C23[C@@]([C@](O1)([C@@H](OC)C=4C2=C(O)C(O)=C(C(C)C)C4O)[H])(C(C)(C)CCC3)[H]
Synonyms:
  • 14-Hydroxy-7-O-methyl rosmanol
  • 2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-
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