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Eucomol

CAT: 0804-HY-N7321-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N7321-01Size:1 mg
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Description
Eucomol has potent cytotoxicity against KKU-M156 and HepG2 cells with the IC50 values of 7.12 and 25.76 μg/mL, respectively. Eucomol can be isolated from an ethanolic extract of D. cochinchinensis[1].
CAS Number
17934-12-2
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Others
Type
Natural Products
Related Pathways
Others
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/eucomol.html
Solubility
10 mM in DMSO
Smiles
O=C1C2=C(O)C=C(O)C=C2OC[C@@]1(O)CC3=CC=C(C=C3)OC
Molecular Formula
C17H16O6
Molecular Weight
316.31
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Prommee N, Iet al. Exploring in vitro anti-proliferative and anti-inflammatory activities of Prasachandaeng remedy, and its bioactive compounds. BMC Complement Med Ther. 2022 Aug 11;22 (1) :217.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Eucomol

Eucomol has been reported in Eucomis bicolor with data available.

CAS Number17934-12-2
PubChem CID101289750
IUPAC Name(3S)-3,5,7-trihydroxy-3-[(4-methoxyphenyl)methyl]-2H-chromen-4-one
Molecular FormulaC17H16O6
Molecular Weight316.30
XLogP2.4
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity433
SMILES
COC1=CC=C(C=C1)C[C@@]2(COC3=CC(=CC(=C3C2=O)O)O)O
InChI
InChI=1S/C17H16O6/c1-22-12-4-2-10(3-5-12)8-17(21)9-23-14-7-11(18)6-13(19)15(14)16(17)20/h2-7,18-19,21H,8-9H2,1H3/t17-/m0/s1
InChIKey
BLSFQQNRFOVLGQ-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of Eucomol
CAS: 17934-12-2
CID: 101289750
Formula: C17H16O6
MW: 316.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.30
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass316.09468823
Monoisotopic Mass316.09468823
Topological Polar Surface Area96.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity433
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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