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1013-69-0 | 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-methyl-
CAS No: 1013-69-0 Catalog No: AG00046V MDL No:MFCD03001435
Product Description
Catalog Number:
AG00046V
Chemical Name:
4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-methyl-
CAS Number:
1013-69-0
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD03001435
IUPAC Name:
5,7-dihydroxy-2-methylchromen-4-one
InChI:
InChI=1S/C10H8O4/c1-5-2-7(12)10-8(13)3-6(11)4-9(10)14-5/h2-4,11,13H,1H3
InChI Key:
NCUJRUDLFCGVOE-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c2c(c1)oc(cc2=O)C
UNII:
M0KFC1Q5JC
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Antitubercular chromones and flavonoids from Pisonia aculeata. | Journal of natural products 20110527 |
| Ceramide and Cerebroside from the stem bark of Ficus mucuso (Moraceae). | Chemical & pharmaceutical bulletin 20101201 |
| Engineered biosynthesis of plant polyketides: structure-based and precursor-directed approach. | Topics in current chemistry 20100101 |
| Chrotacumines A-D, chromone alkaloids from Dysoxylum acutangulum. | Journal of natural products 20091001 |
| Cytotoxic and HIF-1alpha inhibitory compounds from Crossosoma bigelovii. | Journal of natural products 20090522 |
| [Study on chemical constituents from roots of Saussurea lappa]. | Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20090501 |
| Structure-based engineering of a plant type III polyketide synthase: formation of an unnatural nonaketide naphthopyrone. | Journal of the American Chemical Society 20070509 |
| Crystallization and preliminary crystallographic analysis of a novel plant type III polyketide synthase that produces pentaketide chromone. | Acta crystallographica. Section F, Structural biology and crystallization communications 20060901 |
| [Study on the constituents from Neonauclea sessilifolia]. | Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20021201 |
| Anti-AIDS agents, 10. Acacetin-7-O-beta-D-galactopyranoside, an anti-HIV principle from Chrysanthemum morifolium and a structure-activity correlation with some related flavonoids. | Journal of natural products 19940101 |
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