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Anthracenecarboxylic acids and derivatives

Description:

Organic compounds containing a carboxylic acid group (or a derivative thereof) attached to an anthracene ring system.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Anthracenes ⮕ Anthracenecarboxylic acids and derivatives
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Items 13-24 of 39

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  1. Rhein-8-O-β-D-glucopyranoside
      Grade & Purity: 
    • ≥98%
    Cas Number: 113443-70-2        Compound CID:  54676854
    Formula:  C21H16CaO11        Molecular Weight: 484.4
    IUPAC Name:  calcium;3-carboxy-9,10-dioxo-5-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-1,8-diolate
    SMILES:  C1=CC(=C2C(=C1C3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C(=CC(=C4)C(=O)O)[O-])[O-].[Ca+2]
    InChIKey: XXVBCAMVOFYHJP-WJGQHNSASA-L
    InChI:  InChI=1S/C21H18O11.Ca/c22-5-11-16(26)18(28)19(29)20(32-11)7-1-2-9(23)14-13(7)15(25)8-3-6(21(30)31)4-10(24)12(8)17(14)27;/h1-4,11,16,18-20,22-24,26,28-show more
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  2. Sennidin B
      Grade & Purity: 
    • ≥98%
    Cas Number: 517-44-2        EC Number: 208-239-4        Compound CID:  10459879
    Formula:  C30H18O10        Molecular Weight: 538.46
    IUPAC Name:  (9S)-9-[(9R)-2-carboxy-4,5-dihydroxy-10-oxo-9H-anthracen-9-yl]-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid
    SMILES:  C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O
    InChIKey: JPMRHWLJLNKRTJ-SZPZYZBQSA-N
    InChI:  InChI=1S/C30H18O10/c31-17-5-1-3-13-21(15-7-11(29(37)38)9-19(33)25(15)27(35)23(13)17)22-14-4-2-6-18(32)24(14)28(36)26-16(22)8-12(30(39)40)10-20(26)34/hshow more
    Synonyms: Sennidin B | HY-N6935 | (9R,9'S)-4,4',5,5'-tetrahydroxy-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-di...
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  3. CP-640186 hydrochloride
      Grade & Purity: 
    • ≥99%
    Cas Number: 591778-70-0        Compound CID:  23589188
    Formula:  C30H36ClN3O3        Molecular Weight: 522.08
    IUPAC Name:  [(3R)-1-[1-(anthracene-9-carbonyl)piperidin-4-yl]piperidin-3-yl]-morpholin-4-ylmethanone;hydrochloride
    SMILES:  C1CC(CN(C1)C2CCN(CC2)C(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53)C(=O)N6CCOCC6.Cl
    InChIKey: DUBNXJIOBFRASV-GJFSDDNBSA-N
    InChI:  InChI=1S/C30H35N3O3.ClH/c34-29(32-16-18-36-19-17-32)24-8-5-13-33(21-24)25-11-14-31(15-12-25)30(35)28-26-9-3-1-6-22(26)20-23-7-2-4-10-27(23)28;/h1-4,6-show more
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  4. Sennoside B
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 128-57-4        EC Number: 204-895-0        Compound CID:  91440
    Formula:  C42H38O20        Molecular Weight: 862.74
    IUPAC Name:  (9S)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2Sshow more
    SMILES:  C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
    InChIKey: IPQVTOJGNYVQEO-AIFLABODSA-N
    InChI:  InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(show more
    Synonyms: Sennoside B|128-57-4|SennosideB|MLS002473001|CHEBI:34975|F887D1637W|(9R,9'S)-4,4'-dihydroxy-10,10'-dioxo-5,5'-bis(((2...
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  5. Sennoside B
    Cas Number: 128-57-4        EC Number: 204-895-0        Compound CID:  91440
    Formula:  C42H38O20        Molecular Weight: 862.74
    IUPAC Name:  (9S)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2Sshow more
    SMILES:  C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
    InChIKey: IPQVTOJGNYVQEO-AIFLABODSA-N
    InChI:  InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(show more
    Synonyms: F887D1637W | 2-bromoacetylbenzofuran | 5,5'-bis(b-delta-glucopyranosyloxy)-9,9',10,10'-tetrahydro-4,4'-dihydroxy-10,1...
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  6. Sennoside A
      Grade & Purity: 
    • 2mM in DMSO
    Cas Number: 81-27-6        EC Number: 201-339-9        Compound CID:  73111
    Formula:  C42H38O20        Molecular Weight: 862.74
    IUPAC Name:  (9R)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2Sshow more
    SMILES:  C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
    InChIKey: IPQVTOJGNYVQEO-KGFNBKMBSA-N
    InChI:  InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(show more
    Synonyms: Sennoside A|81-27-6|Dosaflex|Gentlax|Sennalax|Senokot|Senolax|Black Draught|8013-11-4|sennoside|NSC 112929|SENNA|2F1O...
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  7. Sennoside A
    Cas Number: 81-27-6        EC Number: 201-339-9        Compound CID:  73111
    Formula:  C42H38O20        Molecular Weight: 862.74
    IUPAC Name:  (9R)-9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2Sshow more
    SMILES:  C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O
    InChIKey: IPQVTOJGNYVQEO-KGFNBKMBSA-N
    InChI:  InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(show more
    Synonyms: CAS-81-27-6 | SENNOSIDE A (CONSTITUENT OF SENNA LEAF AND PODS) [DSC] | 3,4-Dihydro-1(2H)-naphthalenone | Moivat | Sen...
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  8. Rhein 8-Glucoside
      Grade & Purity: 
    • ≥98%
    Cas Number: 34298-86-7        Compound CID:  5320961
    Formula:  C21H18O11        Molecular Weight: 446.36
    IUPAC Name:  4-hydroxy-9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid
    SMILES:  C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O
    InChIKey: WYKUTTFFZMQCGO-HTRBZNBPSA-N
    InChI:  InChI=1S/C21H18O11/c22-6-12-16(25)18(27)19(28)21(32-12)31-11-3-1-2-8-14(11)17(26)13-9(15(8)24)4-7(20(29)30)5-10(13)23/h1-5,12,16,18-19,21-23,25,27-28Hshow more
    Synonyms: Rhein 8-Glucoside | Rhein 8-O-beta-D-Glucopyranoside | HY-N6082 | Rhein-8-glucoside | MS-28043 | CS-0032510 | 4-Hydro...
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  9. Rhein
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 478-43-3        EC Number: 207-521-4        Compound CID:  10168
    Formula:  C15H8O6        Molecular Weight: 284.22
    IUPAC Name:  4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
    SMILES:  C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O
    InChIKey: FCDLCPWAQCPTKC-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)
    Synonyms: Rhein|478-43-3|Monorhein|Rhubarb Yellow|Rheic acid|Cassic acid|4,5-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carb...
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  10. Rhein
    Cas Number: 478-43-3        EC Number: 207-521-4        Compound CID:  10168
    Formula:  C15H8O6        Molecular Weight: 284.22
    IUPAC Name:  4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
    SMILES:  C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O
    InChIKey: FCDLCPWAQCPTKC-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)
    Synonyms: 4,5-Dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylicacid | 4,5-Dihydroxy-9,10-dioxo-9,10-dihydro-2-anthracene...
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  11. Diacerein
    Cas Number: 13739-02-1        EC Number: 237-310-2
    Formula:  C19H12O8        Molecular Weight: 368.29
    IUPAC Name:  4,5-diacetyloxy-9,10-dioxoanthracene-2-carboxylic acid
    SMILES:  CC(=O)OC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OC(=O)C)C(=O)O
    InChIKey: TYNLGDBUJLVSMA-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H12O8/c1-8(20)26-13-5-3-4-11-15(13)18(23)16-12(17(11)22)6-10(19(24)25)7-14(16)27-9(2)21/h3-7H,1-2H3,(H,24,25)
    Synonyms: Diacerein|13739-02-1|Diacerhein|Diacetylrhein|Artrodar|Fisiodar|1,8-DIACETOXY-3-CARBOXYANTHRAQUINONE|DIACERIN|SF-277|...
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  12. Carmine
      Grade & Purity: 
    • ≥40%
    Cas Number: 1390-65-4        EC Number: 215-724-4
    IUPAC Name:  3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid
    SMILES:  CC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O
    InChIKey: DGQLVPJVXFOQEV-UHFFFAOYSA-N
    InChI:  InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,2show more
    Synonyms: DTXSID20859613 | 7-Glucopyranosyl-3,4,5,8-tetrahydroxy-1-methylanthraquinone-2-carboxylic acid | Alum lake of carmini...
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