Products for Research Use Only
RegisterLogin

Demethylbatatasin IV

CAT: 0804-HY-N15325Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-N15325Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Demethylbatatasin IV is a natural compound that can be found in the water yam (Dioscorea alata) [1].
CAS Number
113276-63-4
UNSPSC
12352005
Target
Others
Related Pathways
Others
Field of Research
Others
Smiles
OC1=CC(CCC2=C(O)C=CC=C2)=CC(O)=C1
Molecular Formula
C14H14O3
Molecular Weight
230.26
References & Citations
[1]E.I.Cline, et al. INDUCTION OF PAL ACTIVITY AND DIHYDROSTILBENE PHYTOALEXINS IN DIOSCOREA ALATA AND THEIR PLANT GROWTH INHIBITORY PROPERTIES. Phytochemistry, Vol. 28, No 10, pp. 2621-2625, 1989.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

5-(2-(2-Hydroxyphenyl)ethyl)-1,3-benzenediol

Demethylbatatasin IV is a stilbenoid.

CAS Number113276-63-4
PubChem CID442699
IUPAC Name5-[2-(2-hydroxyphenyl)ethyl]benzene-1,3-diol
Molecular FormulaC14H14O3
Molecular Weight230.26
XLogP3.2
Topological Polar Surface Area60.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity222
SMILES
C1=CC=C(C(=C1)CCC2=CC(=CC(=C2)O)O)O
InChI
InChI=1S/C14H14O3/c15-12-7-10(8-13(16)9-12)5-6-11-3-1-2-4-14(11)17/h1-4,7-9,15-17H,5-6H2
InChIKey
QNLYZTMYRVYPMN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(2-(2-Hydroxyphenyl)ethyl)-1,3-benzenediol
CAS: 113276-63-4
CID: 442699
Formula: C14H14O3
MW: 230.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.26
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass230.094294304
Monoisotopic Mass230.094294304
Topological Polar Surface Area60.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-N14503Mycinamicin IV
HY-N14266Hypelcin A-IV
HY-139011-01IV-361
HY-P1760Allatostatin IV
HY-101335DCG-IV
HY-D0932Sudan IV
HY-N6014Asperosaponin IV
HY-N6945-01Mogroside IV
HY-125131Buddlejasaponin IV
HY-N0431-01Astragaloside IV

Alternative Products

CatalogName
TN8978-01Demethylbatatasin IV

Popular Products