Products for Research Use Only
RegisterLogin

Praeruptorin B (a)

CAT: 0013-GTR19260389-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19260389-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
(-) -Praeruptorin B is a natural product from Peucedanum praeruptorum Dunn.
CAS Number
4970-26-7
Purity
>98% (HPLC)
Solubility
DMSO : 100 mg/mL (234.49 mM)
Molecular Formula
C24H26O7
Molecular Weight
426.46
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

((9R,10R)-8,8-Dimethyl-9-((Z)-2-Methylbut-2-Enoyl)Oxy-2-Oxo-9,10-Dihydropyrano(2,3-F)Chromen-10-Yl) (Z)-2-Methylbut-2-Enoate

Anomalin has been reported in Seseli coronatum, Seseli eriocephalum, and other organisms with data available.

CAS Number4970-26-7
PubChem CID10251869
IUPAC Name[(9R,10R)-8,8-dimethyl-9-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] (Z)-2-methylbut-2-enoate
Molecular FormulaC24H26O7
Molecular Weight426.5
XLogP4.3
Topological Polar Surface Area88.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity835
SMILES
C/C=C(/C)\C(=O)O[C@H]1[C@H](C(OC2=C1C3=C(C=C2)C=CC(=O)O3)(C)C)OC(=O)/C(=C\C)/C
InChI
InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7-,14-8-/t20-,21-/m1/s1
InChIKey
PNTWXEIQXBRCPS-IOWUNYDSSA-N
Chemical Structure
2D Structure
2D structure of ((9R,10R)-8,8-Dimethyl-9-((Z)-2-Methylbut-2-Enoyl)Oxy-2-Oxo-9,10-Dihydropyrano(2,3-F)Chromen-10-Yl) (Z)-2-Methylbut-2-Enoate
CAS: 4970-26-7
CID: 10251869
Formula: C24H26O7
MW: 426.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight426.5
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass426.16785316
Monoisotopic Mass426.16785316
Topological Polar Surface Area88.1 Ų
Heavy Atom Count31
Formal Charge0
Complexity835
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19158573-01Praeruptorin A (b)
GTR19157536-01Praeruptorin C (b)
GTR19154436(+) -Praeruptorin A
GTR19170848-01Praeruptorin A
GTR19158572-01Praeruptorin A
GTR19180775(-) -Praeruptorin A
GTR19169325-01(±) -Praeruptorin A
GTR19200980(+) - Praeruptorin C
GTR19159403-01Praeruptorin E
GTR19169322-01Praeruptorin E

Alternative Products

CatalogName
FP42769(-) -Praeruptorin A
HY-N0081-01(±) -Praeruptorin A
SM1130-25mgPraeruptorin A
MBS5762974(-)-Praeruptorin A
C14229-1mg(+) -Praeruptorin A
MBS3846905-01(+/-)-Praeruptorin A

Popular Products