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29080-58-8

29080-58-8 | 4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxy-

CAS No: 29080-58-8 Catalog No: AG002X8X MDL No:MFCD19441043

Product Description

Catalog Number:
AG002X8X
Chemical Name:
4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxy-
CAS Number:
29080-58-8
Molecular Formula:
C18H16O6
Molecular Weight:
328.3160
MDL Number:
MFCD19441043
IUPAC Name:
2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxychromen-4-one
InChI:
InChI=1S/C18H16O6/c1-21-11-7-12(19)18-13(20)9-15(24-17(18)8-11)10-4-5-14(22-2)16(6-10)23-3/h4-9,19H,1-3H3
InChI Key:
HIXDQWDOVZUNNA-UHFFFAOYSA-N
SMILES:
COc1cc(O)c2c(c1)oc(cc2=O)c1ccc(c(c1)OC)OC

Properties

Complexity:
490  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.095g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
328.32g/mol
Monoisotopic Mass:
328.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Literature

Title Journal
Antiangiogenic polyketides from Peperomia dindygulensis Miq. Molecules (Basel, Switzerland) 20120413
Chemical constituents from tiger's betel, Piper porphyrophyllum N.E.Br. (Fam. Piperaceae). Natural product research 20100301
Pharmacological evaluation of Bioactive Principle of Turnera aphrodisiaca. Indian journal of pharmaceutical sciences 20080101
6-Methylcryptoacetalide, 6-methyl-epicryptoacetalide and 6-methylcryptotanshinone from Salvia aegyptiaca. Phytochemistry 20021001

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