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Gallic acid and derivatives

Description:

Compounds containing a 3,4,5-trihydroxybenzoic acid moiety.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Benzene and substituted derivatives ⮕ Benzoic acids and derivatives ⮕ Hydroxybenzoic acid derivatives ⮕ Gallic acid and derivatives

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  1. Hexyl gallate
    Hexyl gallate
    CAS: 1087-26-9 PubChem CID: 9831030 Formula: C13H18O5 Molecular Weight: 254.28
    ≥99%
    Out of Stock Item #: H1054139
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    Technical Identifiers
    IUPAC Name
    hexyl 3,4,5-trihydroxybenzoate
    SMILES
    CCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey
    DQHJNOHLEKVUHU-UHFFFAOYSA-N
    InChI
    1S/C13H18O5/c1-2-3-4-5-6-18-13(17)9-7-10(14)12(16)11(15)8-9/h7-8,14-16H,2-6H2,1H3
  2. Chebulic acid - ≥99% CAS No(23725-05-5) by Aladdin Scientific
    Chebulic acid
    CAS: 23725-05-5 PubChem CID: 71308174 Formula: C14H12O11 Molecular Weight: 356.24
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: C1340727
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    IUPAC Name
    (2S)-2-[(3S,4S)-3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromen-4-yl]butanedioic acid
    SMILES
    C1=C2C(=C(C(=C1O)O)O)C(C(OC2=O)C(=O)O)C(CC(=O)O)C(=O)O
    InChIKey
    COZMWVAACFYLBI-XJEVXTIOSA-N
    InChI
    1S/C14H12O11/c15-5-1-4-7(10(19)9(5)18)8(3(12(20)21)2-6(16)17)11(13(22)23)25-14(4)24/h1,3,8,11,15,18-19H,2H2,(H,16,17)(H,20,21)(H,22,23)/t3-,8-,11-/m0/show more
    Synonyms
    (2S)-2-[(3S)-3,4-Dihydro-3α-carboxy-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4β-yl]butanedioicacid | Butanedioicacid,[(...
  3. Norbergenin
    Norbergenin
    CAS: 79595-97-4 Formula: C13H14O9 Molecular Weight: 314.24
    ≥98%
    Out of Stock Item #: N1284492
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    Technical Identifiers
    IUPAC Name
    (2R,3S,4S,4aR,10bS)-3,4,8,9,10-pentahydroxy-2-(hydroxymethyl)-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-6-one
    SMILES
    C1=C2C(=C(C(=C1O)O)O)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC2=O
    InChIKey
    GDYGAIKPBLFCKR-OIPGZRGRSA-N
    InChI
    1S/C13H14O9/c14-2-5-8(17)10(19)12-11(21-5)6-3(13(20)22-12)1-4(15)7(16)9(6)18/h1,5,8,10-12,14-19H,2H2/t5-,8-,10+,11+,12-/m1/s1
  4. Gallic acid monohydrate
    Gallic acid monohydrate
    CAS: 5995-86-8 EC Number: 205-749-9 Formula: C7H8O6 Molecular Weight: 188.14
    ≥99%
    In Stock Item #: G741883
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    Technical Identifiers
    IUPAC Name
    3,4,5-trihydroxybenzoic acid;hydrate
    SMILES
    C1=C(C=C(C(=C1O)O)O)C(=O)O.O
    InChIKey
    IUTKPPDDLYYMBE-UHFFFAOYSA-N
    InChI
    1S/C7H6O5.H2O/c8-4-1-3(7(11)12)2-5(9)6(4)10;/h1-2,8-10H,(H,11,12);1H2
    Synonyms
    3,4,5-Trihydroxybezoic acid | 3,4,5-Trihydroxybenzoic acid monohydrate | 3,4,5-Trihydroxybenzoic
  5. Isopropyl 4-Hydroxy-3，5-dimethoxybenzoate
    Isopropyl 4-Hydroxy-3，5-dimethoxybenzoate
    CAS: 858131-80-3 PubChem CID: 71581293 Formula: C12H16O5 Molecular Weight: 240.25
    ≥95%
    Out of Stock Item #: I734971
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    Technical Identifiers
    IUPAC Name
    propan-2-yl 4-hydroxy-3,5-dimethoxybenzoate
    SMILES
    CC(C)OC(=O)C1=CC(=C(C(=C1)OC)O)OC
    InChIKey
    UFDMGVMGWSSNPP-UHFFFAOYSA-N
    InChI
    1S/C12H16O5/c1-7(2)17-12(14)8-5-9(15-3)11(13)10(6-8)16-4/h5-7,13H,1-4H3
  6. Methyl 3，4-dihydroxy-5-methoxybenzoate
    Methyl 3，4-dihydroxy-5-methoxybenzoate
    CAS: 3934-86-9 PubChem CID: 99622 Formula: C9H10O5 Molecular Weight: 198.17
    ≥99%
    Out of Stock Item #: M695355
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    Technical Identifiers
    IUPAC Name
    methyl 3,4-dihydroxy-5-methoxybenzoate
    SMILES
    COC1=CC(=CC(=C1O)O)C(=O)OC
    InChIKey
    LVVUKXKEXOTUPV-UHFFFAOYSA-N
    InChI
    1S/C9H10O5/c1-13-7-4-5(9(12)14-2)3-6(10)8(7)11/h3-4,10-11H,1-2H3
  7. Ethyl 4-hydroxy-3,5-dimethoxybenzoate - ≥97%, CAS No. 3943-80-4 by
    Ethyl 4-hydroxy-3,5-dimethoxybenzoate
    CAS: 3943-80-4 PubChem CID: 19845 Formula: C11H14O5 Molecular Weight: 226.23
    ≥97%
    Out of Stock Item #: E693693
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    Technical Identifiers
    IUPAC Name
    ethyl 4-hydroxy-3,5-dimethoxybenzoate
    SMILES
    CCOC(=O)C1=CC(=C(C(=C1)OC)O)OC
    InChIKey
    WKUVKFZZCHINKG-UHFFFAOYSA-N
    InChI
    1S/C11H14O5/c1-4-16-11(13)7-5-8(14-2)10(12)9(6-7)15-3/h5-6,12H,4H2,1-3H3
    Synonyms
    4-Hydroxy-3,5-Dimethoxy-Benzoic Acid Ethyl Ester | Ethyl 4-Hydroxy-3,5-Dimethoxy-Benzoate
  8. Methyl 4-bromo-7-methoxybenzo[d][1,3]dioxole-5-carboxylate - 97%, used for , CAS No. 81474-46-6, by Aladdin Scientific
    Methyl 4-bromo-7-methoxybenzo[d][1,3]dioxole-5-carboxylate
    CAS: 81474-46-6 PubChem CID: 11449108 Formula: C10H9BrO5 Molecular Weight: 289.08
    ≥97%
    In Stock Item #: M665098
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    Technical Identifiers
    IUPAC Name
    methyl 4-bromo-7-methoxy-1,3-benzodioxole-5-carboxylate
    SMILES
    COC1=C2C(=C(C(=C1)C(=O)OC)Br)OCO2
    InChIKey
    LBTTXOWOLNELBG-UHFFFAOYSA-N
    InChI
    1S/C10H9BrO5/c1-13-6-3-5(10(12)14-2)7(11)9-8(6)15-4-16-9/h3H,4H2,1-2H3
  9. no_selection
    11-O-Syringylbergenin
    CAS: 126485-47-0
    ≥98%
    Out of Stock Item #: O663354
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    Technical Identifiers
    IUPAC Name
    [(2S,3R,4R,4aS,10bR)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoatshow more
    SMILES
    COC1=CC(=CC(=C1O)OC)C(=O)OCC2C(C(C3C(O2)C4=C(C(=C(C=C4C(=O)O3)O)OC)O)O)O
    InChIKey
    GXCBETDJJWPGAQ-PCOXRIKQSA-N
    InChI
    1S/C23H24O13/c1-31-11-4-8(5-12(32-2)15(11)25)22(29)34-7-13-16(26)18(28)21-20(35-13)14-9(23(30)36-21)6-10(24)19(33-3)17(14)27/h4-6,13,16,18,20-21,24-28show more
  10. Gallic acid-d2
    Gallic acid-d2
    CAS: 294660-92-7 Formula: C7H4D2O5 Molecular Weight: 172.13
    Out of Stock Item #: G651639
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    Technical Identifiers
    IUPAC Name
    2,6-dideuterio-3,4,5-trihydroxybenzoic acid
    SMILES
    C1=C(C=C(C(=C1O)O)O)C(=O)O
    InChIKey
    LNTHITQWFMADLM-QDNHWIQGSA-N
    InChI
    1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)/i1D,2D
  11. CDE-096
    CDE-096
    CAS: 1228357-04-7 PubChem CID: 59350299 Formula: C25H20F3NO12 Molecular Weight: 583.42
    ≥98%
    Out of Stock Item #: C649438
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    Technical Identifiers
    IUPAC Name
    [3-[[3-(trifluoromethyl)phenoxy]carbonylamino]-2-(3,4,5-trihydroxybenzoyl)oxypropyl] 3,4,5-trihydroxybenzoate
    SMILES
    C1=CC(=CC(=C1)OC(=O)NCC(COC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)C(F)(F)F
    InChIKey
    OXWKLJPAKUDPJY-UHFFFAOYSA-N
    InChI
    1S/C25H20F3NO12/c26-25(27,28)13-2-1-3-14(8-13)41-24(38)29-9-15(40-23(37)12-6-18(32)21(35)19(33)7-12)10-39-22(36)11-4-16(30)20(34)17(31)5-11/h1-8,15,30show more
  12. no_selection
    dilazep
    CAS: 35898-87-4 PubChem CID: 3074
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: D609894
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    Technical Identifiers
    IUPAC Name
    3-{4-[3-(3,4,5-trimethoxybenzoyloxy)propyl]-1,4-diazepan-1-yl}propyl 3,4,5-trimethoxybenzoate
    SMILES
    COc1cc(cc(c1OC)OC)C(=O)OCCCN1CCCN(CC1)CCCOC(=O)c1cc(OC)c(c(c1)OC)OC
    InChIKey
    QVZCXCJXTMIDME-UHFFFAOYSA-N
    InChI
    1S/C31H44N2O10/c1-36-24-18-22(19-25(37-2)28(24)40-5)30(34)42-16-8-12-32-10-7-11-33(15-14-32)13-9-17-43-31(35)23-20-26(38-3)29(41-6)27(21-23)39-4/h18-2show more
    Synonyms
    Dilazep [INN] | D07843 | NCGC00016747-05 | Q5276700 | SR-01000075817-3 | F8KLC2BD5Z | NCGC00016747-01 | NCGC00016747-...
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