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Chromones
Description:
Compounds containing a benzopyran-4-one moiety.
Ancestors:
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8-Hydroxychroman-4-oneCas Number: 1843-90-9 Compound CID: 11126601Formula: C9H8O3 Molecular Weight: 164.16IUPAC Name: 8-hydroxy-2,3-dihydrochromen-4-oneSMILES: C1COC2=C(C1=O)C=CC=C2OInChIKey: CTRTZLJYANJCHF-UHFFFAOYSA-NInChI: InChI=1S/C9H8O3/c10-7-4-5-12-9-6(7)2-1-3-8(9)11/h1-3,11H,4-5H2 -
8-Nitro-4-chromanoneCas Number: 90322-49-9Formula: C9H7NO4 Molecular Weight: 193.1562SMILES: C1COC2=C(C1=O)C=CC=C2[N+](=O)[O-]InChIKey: MXMKEUBEHSMVOG-UHFFFAOYSA-NInChI: InChI=1S/C9H7NO4/c11-8-4-5-14-9-6(8)2-1-3-7(9)10(12)13/h1-3H,4-5H2
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3，5，7-TrihydroxychromoneCas Number: 31721-95-6 Compound CID: 46886154IUPAC Name: 3,5,7-trihydroxychromen-4-oneSMILES: C1=C(C=C2C(=C1O)C(=O)C(=CO2)O)OInChIKey: OZNMEZAXFKUCPN-UHFFFAOYSA-NInChI: InChI=1S/C9H6O5/c10-4-1-5(11)8-7(2-4)14-3-6(12)9(8)13/h1-3,10-12H
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NoreugeninCas Number: 1013-69-0 Compound CID: 5375252IUPAC Name: 5,7-dihydroxy-2-methylchromen-4-oneSMILES: CC1=CC(=O)C2=C(C=C(C=C2O1)O)OInChIKey: NCUJRUDLFCGVOE-UHFFFAOYSA-NInChI: InChI=1S/C10H8O4/c1-5-2-7(12)10-8(13)3-6(11)4-9(10)14-5/h2-4,11,13H,1H3
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Ethyl 2-amino-7-isopropyl-5-oxo-5H-[1]benzopyrano[2，3-b]pyridine-3-carboxylateCas Number: 68301-99-5Formula: C18H18N2O4 Molecular Weight: 326.35IUPAC Name: ethyl 2-amino-5-oxo-7-propan-2-ylchromeno[2,3-b]pyridine-3-carboxylateSMILES: CCOC(=O)C1=C(N=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(C)C)NInChIKey: PFDJAEKKGJFCNL-UHFFFAOYSA-NInChI: InChI=1S/C18H18N2O4/c1-4-23-18(22)13-8-12-15(21)11-7-10(9(2)3)5-6-14(11)24-17(12)20-16(13)19/h5-9H,4H2,1-3H3,(H2,19,20)Synonyms: Ethyl 2-amino-7-isopropyl-5-oxo-5H-[1]benzopyrano[2,3-b]pyridine-3-carboxylate | Ethyl 2-amino-5-oxo-7-propan-2-ylchr...
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5，8-Difluorochroman-4-oneCas Number: 942196-01-2 Compound CID: 63268732Formula: C9H6F2O2 Molecular Weight: 184.14IUPAC Name: 5,8-difluoro-2,3-dihydrochromen-4-oneSMILES: C1COC2=C(C=CC(=C2C1=O)F)FInChIKey: MFNOPUXJWQFHSE-UHFFFAOYSA-NInChI: InChI=1S/C9H6F2O2/c10-5-1-2-6(11)9-8(5)7(12)3-4-13-9/h1-2H,3-4H2
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Methyl 4-oxochroman-6-carboxylateCas Number: 41118-19-8 Compound CID: 23513066Formula: C11H10O4 Molecular Weight: 206.19IUPAC Name: methyl 4-oxo-2,3-dihydrochromene-6-carboxylateSMILES: COC(=O)C1=CC2=C(C=C1)OCCC2=OInChIKey: LVJGGWLNOHXSKZ-UHFFFAOYSA-NInChI: InChI=1S/C11H10O4/c1-14-11(13)7-2-3-10-8(6-7)9(12)4-5-15-10/h2-3,6H,4-5H2,1H3
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CassiachromoneCas Number: 28955-30-8 Compound CID: 5319500Formula: C13H12O4 Molecular Weight: 232.23IUPAC Name: 7-hydroxy-2-methyl-5-(2-oxopropyl)chromen-4-oneSMILES: CC1=CC(=O)C2=C(C=C(C=C2O1)O)CC(=O)CInChIKey: YMCXDPKFRCHLPK-UHFFFAOYSA-NInChI: InChI=1S/C13H12O4/c1-7(14)3-9-5-10(15)6-12-13(9)11(16)4-8(2)17-12/h4-6,15H,3H2,1-2H3
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8-(Trifluoromethyl)chroman-4-oneCas Number: 890839-66-4 Compound CID: 42614599Formula: C10H7F3O2 Molecular Weight: 216.159IUPAC Name: 8-(trifluoromethyl)-2,3-dihydrochromen-4-oneSMILES: C1COC2=C(C1=O)C=CC=C2C(F)(F)FInChIKey: OQGMJRUOBDTBBF-UHFFFAOYSA-NInChI: InChI=1S/C10H7F3O2/c11-10(12,13)7-3-1-2-6-8(14)4-5-15-9(6)7/h1-3H,4-5H2
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7-hydroxy-2-methyl-4H-chromen-4-oneCas Number: 6320-42-9 Compound CID: 5355309Formula: C10H8O3 Molecular Weight: 176.17IUPAC Name: 7-hydroxy-2-methylchromen-4-oneSMILES: CC1=CC(=O)C2=C(O1)C=C(C=C2)OInChIKey: QIPBSGDZHKDNNJ-UHFFFAOYSA-NInChI: InChI=1S/C10H8O3/c1-6-4-9(12)8-3-2-7(11)5-10(8)13-6/h2-5,11H,1H3
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7-(Trifluoromethyl)chroman-4-oneCas Number: 111141-02-7 Compound CID: 13953821Formula: C10H7F3O2 Molecular Weight: 216.16IUPAC Name: 7-(trifluoromethyl)-2,3-dihydrochromen-4-oneSMILES: C1COC2=C(C1=O)C=CC(=C2)C(F)(F)FInChIKey: BDGGJAUEQDZWRC-UHFFFAOYSA-NInChI: InChI=1S/C10H7F3O2/c11-10(12,13)6-1-2-7-8(14)3-4-15-9(7)5-6/h1-2,5H,3-4H2
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6，8-Dibromochroman-4-oneCas Number: 15773-96-3 Compound CID: 53401189Formula: C9H6Br2O2 Molecular Weight: 305.95IUPAC Name: 6,8-dibromo-2,3-dihydrochromen-4-oneSMILES: C1COC2=C(C1=O)C=C(C=C2Br)BrInChIKey: NPVIVRRXGMSKTH-UHFFFAOYSA-NInChI: InChI=1S/C9H6Br2O2/c10-5-3-6-8(12)1-2-13-9(6)7(11)4-5/h3-4H,1-2H2
