Xanthones

Description:

Polycyclic aromatic compounds containing a xanthene moiety conjugated to a ketone group at carbon 9. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Benzopyrans ⮕ 1-benzopyrans ⮕ Dibenzopyrans ⮕ Xanthenes ⮕ Xanthones

Mangiferin
- ≥98%
Cas Number: 4773-96-0

Formula: C₁₉H₁₈O₁₁ Molecular Weight: 422.34

IUPAC Name: 1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one

SMILES: C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=C(C(=C3)O)C4C(C(C(C(O4)CO)O)O)O)O

InChIKey: AEDDIBAIWPIIBD-ZJKJAXBQSA-N

InChI: InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,1show more

Synonyms: 1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one | DTXCID70119754 |...
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Isomangiferin
- ≥98%
Cas Number: 24699-16-9

Formula: C₁₉H₁₈O₁₁ Molecular Weight: 422.34

IUPAC Name: 1,3,6,7-tetrahydroxy-4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one

SMILES: C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O

InChIKey: CDYBOKJASDEORM-HBVDJMOISA-N

InChI: InChI=1S/C19H18O11/c20-4-11-15(26)16(27)17(28)19(30-11)13-9(24)2-8(23)12-14(25)5-1-6(21)7(22)3-10(5)29-18(12)13/h1-3,11,15-17,19-24,26-28H,4H2/t11-,15show more

Synonyms: 4-Glucosyl-1,3,6,7-tetrahydroxyxanthone | AC-35047 | DTXSID30179435 | (1S)-1,5-anhydro-1-(1,3,6,7-tetrahydroxy-9-oxo-...
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Gambogic acid
- 10mM in DMSO
Cas Number: 2752-65-0

Formula: C₃₈H₄₄O₈ Molecular Weight: 628.75

IUPAC Name: (Z)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.show more

SMILES: CC(=CCCC1(C=CC2=C(C3=C(C(=C2O1)CC=C(C)C)OC45C6CC(C=C4C3=O)C(=O)C5(OC6(C)C)CC=C(C)C(=O)O)O)C)C

InChIKey: GEZHEQNLKAOMCA-RRZNCOCZSA-N

InChI: InChI=1S/C38H44O8/c1-20(2)10-9-15-36(8)16-14-24-29(39)28-30(40)26-18-23-19-27-35(6,7)46-37(33(23)41,17-13-22(5)34(42)43)38(26,27)45-32(28)25(31(24)44-show more

Synonyms: gambogic acid|2752-65-0|(-)-Gambogic Acid|Gambogic-acid|Guttatic acid|R-gambogic acid|Guttic acid|beta-Guttiferin|Cam...
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Gambogenic acid
- ≥98%
Cas Number: 173932-75-7 Compound CID: 10794070

Formula: C₃₈H₄₆O₈ Molecular Weight: 630.77

IUPAC Name: (Z)-4-[(1S,2S,13S,15R)-7-[(2E)-3,7-dimethylocta-2,6-dienyl]-6,8-dihydroxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.show more

SMILES: CC(=CCCC(=CCC1=C(C(=C2C(=C1O)C(=O)C3=CC4CC5C3(O2)C(C4=O)(OC5(C)C)CC=C(C)C(=O)O)CC=C(C)C)O)C)C

InChIKey: RCWNBHCZYXWDOV-VSFMGBBVSA-N

InChI: InChI=1S/C38H46O8/c1-20(2)10-9-11-22(5)13-15-25-30(39)26(14-12-21(3)4)33-29(31(25)40)32(41)27-18-24-19-28-36(7,8)46-37(34(24)42,38(27,28)45-33)17-16-2show more

Synonyms: 2-Butenoic acid,4-[(1R,3aS,5S,12aS)-9-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3a,4,5,7-tetrahydro-...
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Gambogenic acid
- 10mM in DMSO
Cas Number: 173932-75-7 Compound CID: 10794070

Formula: C₃₈H₄₆O₈ Molecular Weight: 630.77

IUPAC Name: (Z)-4-[(1S,2S,13S,15R)-7-[(2E)-3,7-dimethylocta-2,6-dienyl]-6,8-dihydroxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.show more

SMILES: CC(=CCCC(=CCC1=C(C(=C2C(=C1O)C(=O)C3=CC4CC5C3(O2)C(C4=O)(OC5(C)C)CC=C(C)C(=O)O)CC=C(C)C)O)C)C

InChIKey: RCWNBHCZYXWDOV-VSFMGBBVSA-N

InChI: InChI=1S/C38H46O8/c1-20(2)10-9-11-22(5)13-15-25-30(39)26(14-12-21(3)4)33-29(31(25)40)32(41)27-18-24-19-28-36(7,8)46-37(34(24)42,38(27,28)45-33)17-16-2show more

Synonyms: 2-Butenoic acid,4-[(1R,3aS,5S,12aS)-9-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3a,4,5,7-tetrahydro-...
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2-(9-Oxoxanthen-2-yl)propionic Acid
- ≥98%
Cas Number: 30087-33-3

Formula: C₁₆H₁₂O₄ Molecular Weight: 268.27

IUPAC Name: 2-(9-oxoxanthen-2-yl)propanoic acid

SMILES: CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)O

InChIKey: JUCCZCZDAPBGIV-UHFFFAOYSA-N

InChI: InChI=1S/C16H12O4/c1-9(16(18)19)10-6-7-14-12(8-10)15(17)11-4-2-3-5-13(11)20-14/h2-9H,1H3,(H,18,19)

Synonyms: alpha-Methyl-9-oxo-9H-xanthene-2-acetic acid | DTXSID80952497 | alpha-Methyl-2-xanthonylacetic acid | 2-(9-oxo-9h-xan...
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2-(9-Oxoxanthen-2-yl)propionic Acid 1,5,7-Triazabicyclo[4.4.0]dec-5-ene Salt
- ≥98%(HPLC)
Cas Number: 1346753-09-0

Formula: C₂₃H₂₅N₃O₄ Molecular Weight: 407.47

IUPAC Name: 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine;2-(9-oxoxanthen-2-yl)propanoic acid

SMILES: CC(C1=CC2=C(C=C1)OC3=CC=CC=C3C2=O)C(=O)O.C1CNC2=NCCCN2C1

InChIKey: NHCZYSDZAMNWGB-UHFFFAOYSA-N

InChI: InChI=1S/C16H12O4.C7H13N3/c1-9(16(18)19)10-6-7-14-12(8-10)15(17)11-4-2-3-5-13(11)20-14;1-3-8-7-9-4-2-6-10(7)5-1/h2-9H,1H3,(H,18,19);1-6H2,(H,8,9)

Synonyms: 2-(9-Oxoxanthen-2-yl)propionicAcid1,5,7-Triazabicyclo[4.4.0]dec-5-eneSalt | 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]p...
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3-Bromo-9H-xanthen-9-one
- ≥98%(GC)
Cas Number: 500286-36-2

Formula: C₁₃H₇BrO₂ Molecular Weight: 275.1

IUPAC Name: 3-bromoxanthen-9-one

SMILES: C1=CC=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)Br

InChIKey: UEKROUJUENOVKW-UHFFFAOYSA-N

InChI: InChI=1S/C13H7BrO2/c14-8-5-6-10-12(7-8)16-11-4-2-1-3-9(11)13(10)15/h1-7H

Synonyms: 3-Bromoxanthenone | 3-Bromoxanthen-9-one | 3-Bromo-10H-dibenzo[b,e]pyran-10-one
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3,6-Dihydroxy-9H-xanthen-9-one
- ≥98%
Cas Number: 1214-24-0

Formula: C₁₃H₈O₄ Molecular Weight: 228.2

IUPAC Name: 3,6-dihydroxyxanthen-9-one

SMILES: C1=CC2=C(C=C1O)OC3=C(C2=O)C=CC(=C3)O

InChIKey: POARTHFLPKAZBQ-UHFFFAOYSA-N

InChI: InChI=1S/C13H8O4/c14-7-1-3-9-11(5-7)17-12-6-8(15)2-4-10(12)13(9)16/h1-6,14-15H

Synonyms: 3,6-Dihydroxyxanthen-9-one | 3,6-Dihydroxyxanthone
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1,3-Dihydroxy-9H-xanthen-9-one
- ≥96%
Cas Number: 3875-68-1

Formula: C₁₃H₈O₄ Molecular Weight: 228.2

IUPAC Name: 1,3-dihydroxyxanthen-9-one

SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=C(C=C3O2)O)O

InChIKey: GTHOERCJZSJGHB-UHFFFAOYSA-N

InChI: InChI=1S/C13H8O4/c14-7-5-9(15)12-11(6-7)17-10-4-2-1-3-8(10)13(12)16/h1-6,14-15H

Synonyms: 9H-Xanthen-9-one,1,3-dihydroxy- | MFCD00800670 | STL466245 | BDBM174832 | D5344 | XD161541 | 9H-Xanthen-9-one, 1,3-di...
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2-BROMO-9-XANTHENONE
Cas Number: 56341-31-2

Formula: C₁₃H₇BrO₂ Molecular Weight: 275.104

IUPAC Name: 2-bromoxanthen-9-one

SMILES: C1=CC=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)Br

InChIKey: DYQUGFRRGGOYCA-UHFFFAOYSA-N

InChI: InChI=1S/C13H7BrO2/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H

Synonyms: 2-bromo-9H-xanthen-9-one|56341-31-2|2-bromoxanthen-9-one|9H-Xanthen-9-one, 2-bromo-|C13H7BrO2|2-bromoxanthone|2-bromo...

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Neomangiferin
- ≥98%
Cas Number: 64809-67-2

Formula: C₂₅H₂₈O₁₆ Molecular Weight: 584.48

IUPAC Name: 1,3,6-trihydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxshow more

SMILES: C1=C2C(=CC(=C1OC3C(C(C(C(O3)CO)O)O)O)O)OC4=C(C2=O)C(=C(C(=C4)O)C5C(C(C(C(O5)CO)O)O)O)O

InChIKey: VUWOVGXVRYBSGI-IRXABLMPSA-N

InChI: InChI=1S/C25H28O16/c26-4-12-17(31)20(34)22(36)24(39-12)14-8(29)3-11-15(19(14)33)16(30)6-1-10(7(28)2-9(6)38-11)40-25-23(37)21(35)18(32)13(5-27)41-25/h1show more

Synonyms: A914062 | DTXSID401317610 | Neomangiferin | AS-78360 | CCG-270142 | 9H-Xanthen-9-one, 2-beta-D-glucopyranosyl-7-(beta...
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