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Baimaside

CAT: 0804-HY-N2183-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No
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CAT#:0804-HY-N2183-02Size:10 mM - 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Baimaside (Quercetin 3-O-sophoroside) is isolated from the flowers of A. venetum, is a scavenger of superoxide anions[1].
CAS Number
18609-17-1
Product Name Alternative
Quercetin 3-O-sophoroside
UNSPSC
12352005
Hazard Statement
H302, H315, H319
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/baimaside.html
Purity
99.57
Solubility
DMSO : 250 mg/mL (ultrasonic)
Smiles
O=C1C(O[C@H](O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H]2O[C@]([C@@H]([C@@H](O)[C@@H]3O)O)([H])O[C@@H]3CO)=C(C4=CC(O)=C(O)C=C4)OC5=CC(O)=CC(O)=C15
Molecular Formula
C27H30O17
Molecular Weight
626.52
Precautions
H302, H315, H319
References & Citations
[1]Chen L, et al. Studies on chemical constituents from flowers of Apocynum venetum. Zhongguo Zhong Yao Za Zhi. 2005 Sep;30 (17) :1340-2.|[2]Cano A, et al. Superoxide scavenging by polyphenols: effect of conjugation and dimerization. Redox Rep. 2002;7 (6) :379-83.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

quercetin 3-O-sophoroside

Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside is a quercetin O-glucoside that is quercetin attached to a beta-D-sophorosyl residue at position 3 via a glycosidic linkage. It has a role as an antioxidant and a plant metabolite. It is a sophoroside and a tetrahydroxyflavone. It is a conjugate acid of a quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside(1-).

CAS Number18609-17-1
PubChem CID5282166
IUPAC Name3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
Molecular FormulaC27H30O17
Molecular Weight626.5
XLogP-1.2
Topological Polar Surface Area286
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count17
Rotatable Bond Count7
Heavy Atom Count44
Formal Charge0
Complexity1040
SMILES
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O
InChI
InChI=1S/C27H30O17/c28-6-14-17(34)20(37)22(39)26(41-14)44-25-21(38)18(35)15(7-29)42-27(25)43-24-19(36)16-12(33)4-9(30)5-13(16)40-23(24)8-1-2-10(31)11(32)3-8/h1-5,14-15,17-18,20-22,25-35,37-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1
InChIKey
RDUAJIJVNHKTQC-UJECXLDQSA-N
Chemical Structure
2D Structure
2D structure of quercetin 3-O-sophoroside
CAS: 18609-17-1
CID: 5282166
Formula: C27H30O17
MW: 626.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight626.5
XLogP3-1.2
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count17
Rotatable Bond Count7
Exact Mass626.14829948
Monoisotopic Mass626.14829948
Topological Polar Surface Area286 Ų
Heavy Atom Count44
Formal Charge0
Complexity1040
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BUP04446-01Baimaside

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