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7,2'-Dimethoxyisomucronulatol

CAT: 0013-GTR19242855-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242855-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
7,2'-Dimethoxyisomucronulatol is a natural product for life science research. It serves as a biochemical tool for in vitro studies, including investigations into cellular pathways and molecular interactions relevant to plant-derived compound research.
CAS Number
60478-76-4
Smiles
O (C1=CC=C2C (OCC (C3=CC=C (OC) C (OC) =C3OC) C2) =C1) C
Molecular Formula
C19H22O5
Molecular Weight
330.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2H-1-Benzopyran, 3,4-dihydro-7-methoxy-3-(2,3,4-trimethoxyphenyl)-
CAS Number60478-76-4
PubChem CID606662
IUPAC Name7-methoxy-3-(2,3,4-trimethoxyphenyl)-3,4-dihydro-2H-chromene
Molecular FormulaC19H22O5
Molecular Weight330.4
XLogP3.6
Topological Polar Surface Area46.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity390
SMILES
COC1=CC2=C(CC(CO2)C3=C(C(=C(C=C3)OC)OC)OC)C=C1
InChI
InChI=1S/C19H22O5/c1-20-14-6-5-12-9-13(11-24-17(12)10-14)15-7-8-16(21-2)19(23-4)18(15)22-3/h5-8,10,13H,9,11H2,1-4H3
InChIKey
AMLAGXGXHMFDOU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2H-1-Benzopyran, 3,4-dihydro-7-methoxy-3-(2,3,4-trimethoxyphenyl)-
CAS: 60478-76-4
CID: 606662
Formula: C19H22O5
MW: 330.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.4
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass330.14672380
Monoisotopic Mass330.14672380
Topological Polar Surface Area46.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity390
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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