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CAS 56857-65-9

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Spirostan-12-one, 3-(β-D-galactopyranosyloxy)-, (3β,5α,25R)-

Description:
Spirostan-12-one, 3-(β-D-galactopyranosyloxy)-, (3β,5α,25R)- is a steroidal compound characterized by its spirostan structure, which features a unique fused ring system. This compound contains a ketone functional group at the 12-position and a β-D-galactopyranosyloxy group at the 3-position, indicating the presence of a sugar moiety that can enhance its solubility and biological activity. The stereochemistry is specified as (3β,5α,25R), which denotes the spatial arrangement of atoms around the chiral centers, influencing its interaction with biological systems. Spirostan derivatives are often studied for their potential pharmacological properties, including anti-inflammatory and immunomodulatory effects. The presence of the sugar moiety may also suggest potential applications in drug delivery or as a bioactive compound in natural products. Overall, this compound exemplifies the complexity and diversity of steroidal glycosides, which are of interest in both medicinal chemistry and biochemistry.
Formula:C33H52O9
InChI:InChI=1S/C33H52O9/c1-16-7-10-33(39-15-16)17(2)26-23(42-33)12-22-20-6-5-18-11-19(40-30-29(38)28(37)27(36)24(14-34)41-30)8-9-31(18,3)21(20)13-25(35)32(22,26)4/h16-24,26-30,34,36-38H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,23+,24-,26+,27+,28+,29-,30-,31+,32-,33-/m1/s1
InChI key:InChIKey=NVCUAFIUMZCPGV-RGIGLGGVSA-N
SMILES:C[C@@]12[C@@]3([C@@](O[C@@]4([C@H]3C)CC[C@@H](C)CO4)(C[C@]1([C@]5([C@](CC2=O)([C@]6(C)[C@@](CC5)(C[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)CC6)[H])[H])[H])[H])[H])[H]
Synonyms:
  • Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], spirostan-12-one deriv.
  • Spirostan-12-one, 3-(β-D-galactopyranosyloxy)-, (3β,5α,25R)-
  • Agavoside A
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