Products for Research Use Only
RegisterLogin

Purifolin

CAT: 0013-GTR19231689-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19231689-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Purifolin (CAS 62082-22-8) is a natural product suitable for use as a reference standard. It is utilized in biochemical research, including in vitro studies investigating its potential biological activities.
CAS Number
62082-22-8
Smiles
COc1cc (O) c2c (oc (-c3ccc (O) c (O) c3) c (O[C@@H]3O[C@@H] (C) [C@H] (O) [C@@H] (O) [C@H]3O) c2=O) c1OC (C) =O
Molecular Formula
C24H24O13
Molecular Weight
520.443
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Purifolin
CAS Number62082-22-8
PubChem CID45359796
IUPAC Name[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4-oxo-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-8-yl] acetate
Molecular FormulaC24H24O13
Molecular Weight520.4
XLogP0.9
Topological Polar Surface Area202
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count13
Rotatable Bond Count6
Heavy Atom Count37
Formal Charge0
Complexity892
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=C(C2=O)C(=CC(=C3OC(=O)C)OC)O)C4=CC(=C(C=C4)O)O)O)O)O
InChI
InChI=1S/C24H24O13/c1-8-16(29)18(31)19(32)24(34-8)37-23-17(30)15-13(28)7-14(33-3)21(35-9(2)25)22(15)36-20(23)10-4-5-11(26)12(27)6-10/h4-8,16,18-19,24,26-29,31-32H,1-3H3/t8-,16-,18+,19+,24-/m0/s1
InChIKey
XCQNRWMPPLJRCM-PZSVWFBASA-N
Chemical Structure
2D Structure
2D structure of Purifolin
CAS: 62082-22-8
CID: 45359796
Formula: C24H24O13
MW: 520.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight520.4
XLogP30.9
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count13
Rotatable Bond Count6
Exact Mass520.12169082
Monoisotopic Mass520.12169082
Topological Polar Surface Area202 Ų
Heavy Atom Count37
Formal Charge0
Complexity892
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19231681-01Purifolinin

Alternative Products

CatalogName
T124534-01Purifolin

Popular Products