Cas no 40105-60-0 (kievitone)
kievitone structure
Product Name:kievitone
CAS No:40105-60-0
MF:C20H20O6
MW:356.369206428528
CID:925312
PubChem ID:119269
Update Time:2025-04-19
kievitone Chemical and Physical Properties
Names and Identifiers
-
- kievitone
- 3-(2,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
- 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
- 3-(2,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one, 9CI
- UNII-96V5H76C4P
- CS-0082546
- 4H-1-Benzopyran-4-one, 3-(2,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-8-(3-methyl-2-butenyl)-
- SCHEMBL571650
- LMPK12050479
- HY-123351
- 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one
- Vignatin
- Phaseolus substance II
- Q27102101
- DTXSID60960555
- C01590
- CHEBI:16832
- 96V5H76C4P
- 40105-60-0
- Flavanone + 4O, 1Prenyl
- 3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-1-benzopyran-4-one
- KIEVITONE, (+/-)-
- 4H-1-BENZOPYRAN-4-ONE, 3-(2,4-DIHYDROXYPHENYL)-2,3-DIHYDRO-5,7-DIHYDROXY-8-(3-METHYL-2-BUTEN-1-YL)-
-
- Inchi： 1S/C20H20O6/c1-10(2)3-5-13-16(23)8-17(24)18-19(25)14(9-26-20(13)18)12-6-4-11(21)7-15(12)22/h3-4,6-8,14,21-24H,5,9H2,1-2H3
- InChI Key： MERHMOCEIBOOMA-UHFFFAOYSA-N
- SMILES： O1C2C(=C(C=C(C=2C(C(C2C=CC(=CC=2O)O)C1)=O)O)O)C/C=C(\C)/C
Computed Properties
- Exact Mass: 356.126
- Monoisotopic Mass: 356.126
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 3
- Complexity: 542
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.1
- Topological Polar Surface Area: 107?2
Experimental Properties
- Density: 1.384
- Boiling Point: 639.6°C at 760 mmHg
- Flash Point: 231.4°C
- Refractive Index: 1.663
kievitone Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Congyu Li,Wenfu Wang,Haiyan Wang,Guokai Yan,Weiyang Dong,Zhaosheng Chu,Huan Wang,Yang Chang RSC Adv., 2021,11, 26721-26731
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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