0407-0013 Screening compound: 5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]methyl}tetrahydro-2H-pyran-2-yl)oxy]-4H-chromen-4-one

0407-0013 Screening compound: 5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]methyl}tetrahydro-2H-pyran-2-yl)oxy]-4H-chromen-4-one
0407-0013 Screening compound: 5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]methyl}tetrahydro-2H-pyran-2-yl)oxy]-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0407-0013
5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]methyl}tetrahydro-2H-pyran-2-yl)oxy]-4H-chromen-4-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

0407-0013

Molecular Formula

C33H40O19 (C33 H40 O19)

Compound Name

5-hydroxy-2-(4-hydroxyphenyl)-7-[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]methyl}tetrahydro-2H-pyran-2-yl)oxy]-4H-chromen-4-one

IUPAC name

n/a

SMILES

CC(C(C(C1O)O)O)OC1OCC(C(C(C1O)O)O)OC1OC1=C(c(cc2)ccc2O)Oc(cc(cc2O)OC(C(C3O)O)OC(C)C3O)c2C1=O

InChI

InChI=1S/C33H40O19/c1-10-19(36)23(40)26(43)31(47-10)46-9-17-21(38)25(42)28(45)33(51-17)52-30-22(39)18-15(35)7-14(49-32-27(44)24(41)20(37)11(2)48-32)8-16(18)50-29(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-28,31-38,40-45H,9H2,1-2H3

InChI Key

PEFASEPMJYRQBW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

740.67

Hydrogen Bond Acceptors Count

20.00

Hydrogen Bond Donors Count

11.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

19

Partition Coefficient, logP

-2.290

Distribution Coefficient, logD

-2.293

Water Solubility, LogSw

-2.08

Polar Surface Area

243.081

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

15.00

Percent sp3 carbon bonding

54.50

References: we are preparing a list of scientific research reports with 0407-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0407-0013?
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What is the minimum amount of 0407-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0407-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0407-0013
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 0407-0013 available by request