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CAS 58546-17-1

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Spirostan-12-one, 3-[(O-β-D-xylopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→4)-β-D-galactopyranosyl)oxy]-, (3β,5α,25R)-

Description:
Spirostan-12-one, 3-[(O-β-D-xylopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→4)-β-D-galactopyranosyl)oxy]-, (3β,5α,25R)- is a complex glycosylated steroid compound characterized by its spirostan structure, which features a steroid backbone with a ketone functional group at the 12-position. The presence of multiple sugar moieties, including xylopyranose, glucopyranose, and galactopyranose, indicates that this compound is a glycoside, which can influence its solubility, bioactivity, and interaction with biological systems. The stereochemistry at the 3β, 5α, and 25R positions suggests specific spatial arrangements that may affect its pharmacological properties. This compound may exhibit various biological activities, potentially including anti-inflammatory or immunomodulatory effects, making it of interest in pharmaceutical research. Its complex structure and glycosylation pattern may also contribute to its stability and bioavailability, which are critical factors in drug development. Further studies would be necessary to fully elucidate its properties and potential applications.
Formula:C50H80O23
InChI:InChI=1S/C50H80O23/c1-19-7-10-50(65-17-19)20(2)32-27(73-50)12-25-23-6-5-21-11-22(8-9-48(21,3)24(23)13-31(55)49(25,32)4)66-45-39(62)36(59)41(29(15-52)68-45)70-46-40(63)37(60)42(30(16-53)69-46)71-47-43(35(58)34(57)28(14-51)67-47)72-44-38(61)33(56)26(54)18-64-44/h19-30,32-47,51-54,56-63H,5-18H2,1-4H3
InChI key:InChIKey=WJBORTPOEMQYQL-UHFFFAOYSA-N
SMILES:CC12C3C(CC1C4C(CC2=O)C5(C)C(CC4)CC(OC6OC(CO)C(OC7OC(CO)C(OC8C(OC9C(O)C(O)C(O)CO9)C(O)C(O)C(CO)O8)C(O)C7O)C(O)C6O)CC5)OC%10(C3C)CCC(C)CO%10
Synonyms:
  • Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], spirostan-12-one deriv.
  • Agavasaponin C'
  • Agavoside C'
  • Spirostan-12-one, 3-[(O-β-D-xylopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→4)-β-D-galactopyranosyl)oxy]-, (3β,5α,25R)-
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