Hydroxycoumarins

Description:

Coumarins that contain one or more hydroxyl groups attached to the coumarin skeleton.

Ancestors:

Organic compounds ⮕ Phenylpropanoids and polyketides ⮕ Coumarins and derivatives ⮕ Hydroxycoumarins

Hydrangetin
- ≥98%
Cas Number: 485-90-5 Compound CID: 5316302

IUPAC Name: 7-hydroxy-8-methoxychromen-2-one

SMILES: COC1=C(C=CC2=C1OC(=O)C=C2)O

InChIKey: HAQWEMHXSIRYBE-UHFFFAOYSA-N

InChI: InChI=1S/C10H8O4/c1-13-10-7(11)4-2-6-3-5-8(12)14-9(6)10/h2-5,11H,1H3
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7-demethylsuberosin
- ≥98%
- Originating from Korean Angelica sinensis and Dai medicine Sanya Ku
Cas Number: 21422-04-8 Compound CID: 5316525

Formula: C₁₄H₁₄O₃ Molecular Weight: 230.26

IUPAC Name: 7-hydroxy-6-(3-methylbut-2-enyl)chromen-2-one

SMILES: CC(=CCC1=C(C=C2C(=C1)C=CC(=O)O2)O)C

InChIKey: FIDUIAPDSKSUGO-UHFFFAOYSA-N

InChI: InChI=1S/C14H14O3/c1-9(2)3-4-10-7-11-5-6-14(16)17-13(11)8-12(10)15/h3,5-8,15H,4H2,1-2H3
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6-Acetyl-7-hydroxy-4-methyl-2H-chromen-2-one
- ≥95%
Cas Number: 16555-98-9 Compound CID: 5977496

Formula: C₁₂H₁₀O₄ Molecular Weight: 218.21

IUPAC Name: 6-acetyl-7-hydroxy-4-methylchromen-2-one

SMILES: CC1=CC(=O)OC2=CC(=C(C=C12)C(=O)C)O

InChIKey: AYAFDQIOLUUJHW-UHFFFAOYSA-N

InChI: InChI=1S/C12H10O4/c1-6-3-12(15)16-11-5-10(14)9(7(2)13)4-8(6)11/h3-5,14H,1-2H3
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4-Hydroxy-6-methoxy-2H-chromen-2-one
- ≥95%
Cas Number: 13252-84-1 Compound CID: 54676530

Formula: C₁₀H₈O₄ Molecular Weight: 192.17

IUPAC Name: 4-hydroxy-6-methoxychromen-2-one

SMILES: COC1=CC2=C(C=C1)OC(=O)C=C2O

InChIKey: KFXXRRQBVLINPH-UHFFFAOYSA-N

InChI: InChI=1S/C10H8O4/c1-13-6-2-3-9-7(4-6)8(11)5-10(12)14-9/h2-5,11H,1H3
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4-Hydroxy-6，7-dimethylcoumarin
- ≥95%
Cas Number: 55004-77-8 Compound CID: 54682088

Formula: C₁₁H₁₀O₃ Molecular Weight: 190.2

IUPAC Name: 4-hydroxy-6,7-dimethylchromen-2-one

SMILES: CC1=CC2=C(C=C1C)OC(=O)C=C2O

InChIKey: AYHZQBMBPNZPEY-UHFFFAOYSA-N

InChI: InChI=1S/C11H10O3/c1-6-3-8-9(12)5-11(13)14-10(8)4-7(6)2/h3-5,12H,1-2H3
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3-Acetyl-4-hydroxy-2H-chromen-2-one
- ≥95%
Cas Number: 2555-37-5 Compound CID: 54677403

Formula: C₁₁H₈O₄ Molecular Weight: 204.18

IUPAC Name: 3-acetyl-4-hydroxychromen-2-one

SMILES: CC(=O)C1=C(C2=CC=CC=C2OC1=O)O

InChIKey: UTZHUXAPJIBIBQ-UHFFFAOYSA-N

InChI: InChI=1S/C11H8O4/c1-6(12)9-10(13)7-4-2-3-5-8(7)15-11(9)14/h2-5,13H,1H3
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1，1，1，3，3，3-Hexafluoro-2-methylpropan-2-yl 4-[(4-hydroxy-2-oxo-2H-chromen-3-yl)methyl]benzoate
Cas Number: 867257-26-9 Compound CID: 54718618

Formula: C₂₁H₁₄F₆O₅ Molecular Weight: 460.3

IUPAC Name: (1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl) 4-[(4-hydroxy-2-oxochromen-3-yl)methyl]benzoate

SMILES: CC(C(F)(F)F)(C(F)(F)F)OC(=O)C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3OC2=O)O

InChIKey: QFLNTQDOVCLQKW-UHFFFAOYSA-N

InChI: InChI=1S/C21H14F6O5/c1-19(20(22,23)24,21(25,26)27)32-17(29)12-8-6-11(7-9-12)10-14-16(28)13-4-2-3-5-15(13)31-18(14)30/h2-9,28H,10H2,1H3

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Methyl 2-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
- ≥95%
Cas Number: 95903-37-0 Compound CID: 5396665

Formula: C₁₃H₁₂O₅ Molecular Weight: 248.23

IUPAC Name: methyl 2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetate

SMILES: CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)OC

InChIKey: CXVNWNKFVYXEHU-UHFFFAOYSA-N

InChI: InChI=1S/C13H12O5/c1-7-9-4-3-8(14)5-11(9)18-13(16)10(7)6-12(15)17-2/h3-5,14H,6H2,1-2H3
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7-hydroxy-3-methyl-2H-chromen-2-one
Cas Number: 4069-67-4 Compound CID: 13235410

Formula: C₁₀H₈O₃ Molecular Weight: 176.17

IUPAC Name: 7-hydroxy-3-methylchromen-2-one

SMILES: CC1=CC2=C(C=C(C=C2)O)OC1=O

InChIKey: ZLQJVGSVJRBUNL-UHFFFAOYSA-N

InChI: InChI=1S/C10H8O3/c1-6-4-7-2-3-8(11)5-9(7)13-10(6)12/h2-5,11H,1H3

Synonyms: 7-hydroxy-3-methyl-2H-chromen-2-one | 7-hydroxy-3-methylchromen-2-one | 2H-1-Benzopyran-2-one, 7-hydroxy-3-methyl- | ...

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7-Hydroxy-4-methyl-3-propyl-2H-chromen-2-one
Cas Number: 19491-93-1 Compound CID: 5375160

Formula: C₁₃H₁₄O₃ Molecular Weight: 218.25

IUPAC Name: 7-hydroxy-4-methyl-3-propylchromen-2-one

SMILES: CCCC1=C(C2=C(C=C(C=C2)O)OC1=O)C

InChIKey: HKJUWQFMRNKNAF-UHFFFAOYSA-N

InChI: InChI=1S/C13H14O3/c1-3-4-11-8(2)10-6-5-9(14)7-12(10)16-13(11)15/h5-7,14H,3-4H2,1-2H3

Synonyms: 7-Hydroxy-4-methyl-3-propyl-2H-chromen-2-one | 2H-1-Benzopyran-2-one, 7-hydroxy-4-methyl-3-propyl- | 7-hydroxy-4-meth...

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7-Hydroxy-8-prop-2-enylchromen-2-one
Cas Number: 55136-72-6

Formula: C₁₂H₁₀O₃ Molecular Weight: 202.21

IUPAC Name: 7-hydroxy-8-prop-2-enylchromen-2-one

SMILES: C=CCC1=C(C=CC2=C1OC(=O)C=C2)O

InChIKey: BVHRLXSFKYPLBR-UHFFFAOYSA-N

InChI: InChI=1S/C12H10O3/c1-2-3-9-10(13)6-4-8-5-7-11(14)15-12(8)9/h2,4-7,13H,1,3H2

Synonyms: 7-hydroxy-8-prop-2-enylchromen-2-one | 2H-1-Benzopyran-2-one, 7-hydroxy-8-(2-propenyl)- | 8-Allyl-7-hydroxy-chromen-2...

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4-hydroxy-3-[(4-hydroxy-2-oxo-2H-chromen-3-yl)(thiophen-2-yl)methyl]-2H-chromen-2-one
Cas Number: 15938-73-5 Compound CID: 54679916

Formula: C₂₃H₁₄O₆S Molecular Weight: 418.4

IUPAC Name: 4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)-thiophen-2-ylmethyl]chromen-2-one

SMILES: C1=CC=C2C(=C1)C(=C(C(=O)O2)C(C3=CC=CS3)C4=C(C5=CC=CC=C5OC4=O)O)O

InChIKey: VGJKTZUBVAMNAZ-UHFFFAOYSA-N

InChI: InChI=1S/C23H14O6S/c24-20-12-6-1-3-8-14(12)28-22(26)18(20)17(16-10-5-11-30-16)19-21(25)13-7-2-4-9-15(13)29-23(19)27/h1-11,17,24-25H

Synonyms: NSC686395 | 4-hydroxy-3-[(4-hydroxy-2-oxo-2H-chromen-3-yl)(thiophen-2-yl)methyl]-2H-chromen-2-one | 3,3'-(thiophen-2-...

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