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CAS 101219-55-0

:

(1R,2S,4aR,5S,11bS)-2,3,4,4a-Tetrahydro-7-methoxy-1H,6H-5,11b-ethano[1,3]dioxolo[4,5-j]phenanthridine-1,2-diol

Description:
The chemical substance with the name "(1R,2S,4aR,5S,11bS)-2,3,4,4a-Tetrahydro-7-methoxy-1H,6H-5,11b-ethano[1,3]dioxolo[4,5-j]phenanthridine-1,2-diol" and CAS number "101219-55-0" is a complex organic compound characterized by its unique stereochemistry and structural features. It belongs to the class of phenanthridine derivatives, which are known for their diverse biological activities. The presence of multiple chiral centers contributes to its potential for enantioselective interactions in biological systems. The methoxy group and dioxole moiety suggest that the compound may exhibit interesting electronic properties and reactivity. Additionally, the hydroxyl groups indicate potential for hydrogen bonding, which can influence solubility and interaction with biological targets. Such compounds are often studied for their pharmacological properties, including potential anti-cancer or anti-inflammatory effects. Overall, this substance exemplifies the complexity and diversity of organic molecules, particularly in the context of medicinal chemistry and drug design.
Formula:C17H21NO5
InChI:InChI=1S/C17H21NO5/c1-21-14-9-7-18-5-4-17(13(18)3-2-11(19)16(17)20)10(9)6-12-15(14)23-8-22-12/h6,11,13,16,19-20H,2-5,7-8H2,1H3/t11-,13+,16-,17-/m0/s1
InChI key:InChIKey=YDHBKYCFICHVSW-LPOXYFBYSA-N
SMILES:O[C@@H]1[C@@]23C=4C(=C(OC)C5=C(C4)OCO5)C[N@@]([C@@]2(CC[C@@H]1O)[H])CC3
Synonyms:
  • Bulbisine
  • 1H,6H-5,11b-Ethano[1,3]dioxolo[4,5-j]phenanthridine-1,2-diol, 2,3,4,4a-tetrahydro-7-methoxy-, (1R,2S,4aR,5S,11bS)-
  • (1R,2S,4aR,5S,11bS)-2,3,4,4a-Tetrahydro-7-methoxy-1H,6H-5,11b-ethano[1,3]dioxolo[4,5-j]phenanthridine-1,2-diol
  • 1H,6H-5,11b-Ethano[1,3]dioxolo[4,5-j]phenanthridine-1,2-diol, 2,3,4,4a-tetrahydro-7-methoxy-, [1R-(1α,2α,4aβ,5α,11bα)]-
  • Crinan-1,2-diol, 7-methoxy-, (1β,2β)-
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