AG00D8OU

480-23-9 | 3',4',5,7-TETRAHYDROXYISOFLAVONE

AG00D8OU

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CAS Number	480-23-9
Catalog Number	AG00D8OU(AGN-PC-0LPKGZ)
Chemical Name	3',4',5,7-TETRAHYDROXYISOFLAVONE
IUPAC Name	3-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
InChI	InChI=1S/C15H10O6/c16-8-4-12(19)14-13(5-8)21-6-9(15(14)20)7-1-2-10(17)11(18)3-7/h1-6,16-19H
InChI Key	IOYHCQBYQJQBSK-UHFFFAOYSA-N
MDL Number	MFCD00210595
Molecular Formula	C15H10O6
Molecular Weight	286.2363
NSC Number	678114
SMILES	O=C1C(C2=CC=C(O)C(O)=C2)=COC3=CC(O)=CC(O)=C13
UNII	LU8UZM1T51
Synonyms	3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one, isoluteolin, orobol, Orobol, 480-23-9, Isoluteolin, 5,7,3',4'-Tetrahydroxyisoflavone, 3',4',5,7-Tetrahydroxyisoflavone, 3'-hydroxygenistein, Norsantal, Santol, UNII-LU8UZM1T51, CHEBI:69437, BRN 0292790, LU8UZM1T51, 3-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one, NSC678114, 5,7-Dihydroxy-3-(3,4-dihydroxyphenyl)-4H-1-benzopyran-4-one, Isoflavone, 3',4',5,7-tetrahydroxy- (7CI,8CI), 3-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one, 4H-1-Benzopyran-4-one, 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(3,4-dihydroxyphenyl)-, 3'-hydroxy-genistein, NSC 678114, AC1NQZ45, 5-18-05-00318 (Beilstein Handbook Reference), SCHEMBL662881, CHEMBL241609, 5,3',4'-Tetrahydroxyisoflavone, DTXSID20197380, ZINC6092209, BDBM50025463, LMPK12050251, AKOS024284499, 3'',4'',5,7-Tetrahydroxyisoflavone, MCULE-6891042715, NSC-678114, 4CN-1399, LS-39587, ST077113, W1721, C10510, Isoflavone,3',4',5,7-tetrahydroxy- (7CI,8CI), 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one, 3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one, 5,7-dihydroxy-3-(3,4-dihydroxyphenyl)-4-1H-benzopyran-4-one, Quercetin dihydrate, 3'-OH-genistein, C15H10O6, C15-H10-O6, CID5281801, C482258, 6151-25-3,

Complexity	447
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	286.048g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	286.239g/mol
Monoisotopic Mass	286.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	107A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number