CAS 77658-50-5
:(1β,3β,23S,24R,25S)-1-[(O-D-Apio-β-D-furanosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-3,23,24-trihydroxy-18-norspirosta-5,13-dien-15-one
Description:
The chemical substance with the name "(1β,3β,23S,24R,25S)-1-[(O-D-Apio-β-D-furanosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-3,23,24-trihydroxy-18-norspirosta-5,13-dien-15-one" and CAS number "77658-50-5" is a complex glycosylated steroid compound. It features a spirostane core structure, characterized by multiple hydroxyl groups that contribute to its potential biological activity. The presence of various sugar moieties indicates that it may exhibit significant solubility in polar solvents and could interact with biological systems through glycosylation pathways. The stereochemistry, denoted by specific configurations at various carbon centers, suggests that the compound may have specific interactions with biological receptors or enzymes. This compound is of interest in the field of natural products and pharmacology, as glycosylated steroids often display unique pharmacological properties, including anti-inflammatory and anticancer activities. Further studies would be necessary to elucidate its precise biological functions and potential therapeutic applications.
Formula:C47H70O23
InChI:InChI=1S/C47H70O23/c1-16-11-64-47(39(58)29(16)52)17(2)27-22-7-8-23-21(28(22)32(55)36(27)70-47)6-5-19-9-20(49)10-26(45(19,23)4)66-43-38(35(25(51)13-62-43)67-41-33(56)31(54)24(50)12-61-41)69-42-34(57)37(30(53)18(3)65-42)68-44-40(59)46(60,14-48)15-63-44/h5,16-18,20-21,23-27,29-31,33-44,48-54,56-60H,6-15H2,1-4H3/t16-,17-,18-,20+,21+,23-,24+,25-,26+,27+,29+,30-,31-,33+,34+,35-,36+,37+,38+,39-,40-,41-,42-,43-,44-,45-,46+,47-/m0/s1
InChI key:InChIKey=DTEXDRWNOZAWNZ-TVBPKDTLSA-N
SMILES:C[C@@H]1[C@]2(O[C@@]3([C@]1(C4=C(C3=O)[C@]5([C@](CC4)([C@@]6(C)[C@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@H](O[C@H]9[C@H](O)[C@](CO)(O)CO9)[C@@H](O)[C@H](C)O8)[C@@H](O[C@H]%10[C@H](O)[C@@H](O)[C@H](O)CO%10)[C@@H](O)CO7)C[C@H](O)CC6=CC5)[H])[H])[H])[H])[C@@H](O)[C@H](O)[C@@H](C)CO2
Synonyms:- Deoxytrillenoside A
- 18-Norspirosta-5,13-dien-15-one, 1-[(O-D-apio-β-D-furanosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-3,23,24-trihydroxy-, (1β,3β,23S,24R,25S)-
- 21-Deoxytrillenoside A
- (1β,3β,23S,24R,25S)-1-[(O-D-Apio-β-D-furanosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-xylopyranosyl-(1→3)]-α-L-arabinopyranosyl)oxy]-3,23,24-trihydroxy-18-norspirosta-5,13-dien-15-one
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