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Alcesefoliside

CAT: 0013-GTR19183912-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19183912-01Size:1 mg
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Description
Alcesefoliside demonstrates cytoprotective effects comparable to silymarin at a concentration of 60 μg/mL. This natural compound is utilized in research areas such as hepatoprotection and oxidative stress, with studies exploring its potential in both in vitro cell-based assays and in vivo experimental models.
CAS Number
124151-38-8
Smiles
C[C@H]1[C@@H] ([C@H] ([C@H] ([C@@H] (O1) OC[C@@H]2[C@@H] ([C@@H] ([C@H] ([C@@H] (O2) OC3=C (OC4=CC (=CC (=C4C3=O) O) O) C5=CC (=C (C=C5) O) O) O[C@H]6[C@@H] ([C@@H] ([C@H] ([C@@H] (O6) C) O) O) O) O) O) O) O) O
Molecular Formula
C33H40O20
Molecular Weight
756.66
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Alcesefoliside

Alcesefoliside has been reported in Vicia amurensis, Fraxinus americana, and other organisms with data available.

CAS Number124151-38-8
PubChem CID11828754
IUPAC Name2-(3,4-dihydroxyphenyl)-3-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5,7-dihydroxychromen-4-one
Molecular FormulaC33H40O20
Molecular Weight756.7
XLogP-2.4
Topological Polar Surface Area324
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count20
Rotatable Bond Count8
Heavy Atom Count53
Formal Charge0
Complexity1300
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O[C@H]6[C@@H]([C@@H]([C@H]([C@@H](O6)C)O)O)O)O)O)O)O)O
InChI
InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21-,23+,24+,25-,26+,27+,30+,31+,32-,33-/m0/s1
InChIKey
HKNBJSRIYRDSLB-MIORVHIISA-N
Chemical Structure
2D Structure
2D structure of Alcesefoliside
CAS: 124151-38-8
CID: 11828754
Formula: C33H40O20
MW: 756.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight756.7
XLogP3-2.4
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count20
Rotatable Bond Count8
Exact Mass756.21129366
Monoisotopic Mass756.21129366
Topological Polar Surface Area324 Ų
Heavy Atom Count53
Formal Charge0
Complexity1300
Isotope Atom Count0
Defined Atom Stereocenter Count15
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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