Cas no 765316-44-7 (Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside])

Heraclenol 3'-O-[β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside] is a bioactive glycoside compound derived from certain plant species, notably within the Apiaceae family. This molecule features a unique apiofuranosyl-glucopyranoside linkage, which enhances its solubility and stability in aqueous solutions. Its structural complexity contributes to potential pharmacological applications, including anti-inflammatory and antioxidant properties. The compound’s glycosidic bond configuration may also influence its bioavailability and interaction with biological targets. Analytical standards of this substance are valuable for research in natural product chemistry, phytochemistry, and drug discovery, offering a precise reference for qualitative and quantitative studies. Its well-defined structure ensures reproducibility in experimental applications.
Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside] structure
765316-44-7 structure
Product Name:Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside]
CAS No:765316-44-7
MF:C27H34O15
MW:598.54987
CID:837483
PubChem ID:11758254
Update Time:2025-10-15

Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside] Chemical and Physical Properties

Names and Identifiers

    • Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside]
    • (3R)-3-Hydroxy-2-methyl-4-[(7-oxo-7H-furo[3,2-g]chromen-9-yl)oxy] -2-butanyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahy dro-2-furanyl]-β-D-glucopyranoside
    • HERACLENOL 3'-O-[BETA-DAPIOFURANOSYL-(1-6)-BETA-DGLUCOPYRANOSIDE]
    • Heraclenol 3'-O-β-D-apiofuranosyl-(1→6)-β-D-glucopyranoside
    • Heraclenol 3/'-O-beta-D-apiofuranosyl-(1-->6)-beta-D-glucopyranoside
    • 9-[(2R)-3-{[(2S,3R,4S,5S,6R)-6-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-hydroxy-3-methylbutoxy]-7H-furo[3,2-g]chromen-7-one
    • 765316-44-7
    • 9-[(2R)-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one
    • AKOS032962222
    • FS-9020
    • [ "" ]
    • Inchi： InChI=1S/C27H34O15/c1-26(2,15(29)9-37-22-20-13(5-6-36-20)7-12-3-4-16(30)41-21(12)22)42-24-19(33)18(32)17(31)14(40-24)8-38-25-23(34)27(35,10-28)11-39-25/h3-7,14-15,17-19,23-25,28-29,31-35H,8-11H2,1-2H3/t14-,15-,17-,18+,19-,23+,24+,25-,27-/m1/s1
    • InChI Key： AGQARHVGJIEPHM-PMTISCEQSA-N
    • SMILES： CC(C)([C@@H](COc1c2c(ccc(=O)o2)cc3c1occ3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@](CO5)(CO)O)O)O)O)O

Computed Properties

  • Exact Mass: 598.18977037g/mol
  • Monoisotopic Mass: 598.18977037g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 15
  • Heavy Atom Count: 42
  • Rotatable Bond Count: 10
  • Complexity: 977
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 9
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.8
  • Topological Polar Surface Area: 227?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 906.9±65.0 °C at 760 mmHg
  • Flash Point: 502.3±34.3 °C
  • PSA: 231.11000
  • LogP: -1.66110
  • Vapor Pressure: 0.0±0.3 mmHg at 25°C

Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside] Security Information

Heraclenol 3'-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside] Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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A2B Chem LLC
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