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Galloyl esters

Description:

Organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Benzene and substituted derivatives ⮕ Benzoic acids and derivatives ⮕ Hydroxybenzoic acid derivatives ⮕ Gallic acid and derivatives ⮕ Galloyl esters
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Items 1-12 of 22

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  1. CDE-096
      Grade & Purity: 
    • ≥98%
    Cas Number: 1228357-04-7        Compound CID:  59350299
    Formula:  C25H20F3NO12        Molecular Weight: 583.42
    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:  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/h1-8show more
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  2. 3,5-Di-O-galloylshikimic acid
      Grade & Purity: 
    • ≥95%(LC/MS-ELSD)
    Cas Number: 95753-52-9
    Formula:  C21H18O13        Molecular Weight: 478.36
    IUPAC Name:  (3R,4S,5R)-4-hydroxy-3,5-bis[(3,4,5-trihydroxybenzoyl)oxy]cyclohexene-1-carboxylic acid
    SMILES:  C1C(C(C(C=C1C(=O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O
    InChIKey: GASRJYBPBZZTBO-IIDMSEBBSA-N
    InChI:  InChI=1S/C21H18O13/c22-10-1-8(2-11(23)16(10)26)20(31)33-14-5-7(19(29)30)6-15(18(14)28)34-21(32)9-3-12(24)17(27)13(25)4-9/h1-5,14-15,18,22-28H,6H2,(H,2show more
    Synonyms: 3,5-Di-O-galloylshikimic acid | AKOS040734023 | BDBM50469580 | Benzoic acid, 3,4,5-trihydroxy-, (1R,2S,3R)-5-carboxy-...
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  3. Propyl gallate
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 121-79-9        EC Number: 204-498-2
    Formula:  C10H12O5        Molecular Weight: 212.2
    IUPAC Name:  propyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: ZTHYODDOHIVTJV-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3
    Synonyms: propyl gallate|121-79-9|Propyl 3,4,5-trihydroxybenzoate|N-Propyl gallate|Tenox PG|Progallin P|Gallic acid, propyl est...
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  4. Octyl gallate
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 1034-01-1        EC Number: 213-853-0
    Formula:  C15H22O5        Molecular Weight: 282.33
    IUPAC Name:  octyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: NRPKURNSADTHLJ-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H22O5/c1-2-3-4-5-6-7-8-20-15(19)11-9-12(16)14(18)13(17)10-11/h9-10,16-18H,2-8H2,1H3
    Synonyms: Octyl gallate|1034-01-1|Octyl 3,4,5-trihydroxybenzoate|n-Octyl gallate|Progallin O|Stabilizer GA 8|n-Octylgallate|Gal...
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  5. Methyl gallate
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 99-24-1
    Formula:  C8H8O5        Molecular Weight: 184.15
    IUPAC Name:  methyl 3,4,5-trihydroxybenzoate
    SMILES:  COC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: FBSFWRHWHYMIOG-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H8O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3,9-11H,1H3
    Synonyms: GALLIC ACID METHYL ESTER [MI] | Methyl 3,4,5-trihydroxybenzoate | BBL010505 | AI3-00861 | SMR000156263 | AC-11364 | M...
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  6. Ethyl gallate
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 831-61-8        EC Number: 212-608-5
    Formula:  C9H10O5        Molecular Weight: 198.17
    IUPAC Name:  ethyl 3,4,5-trihydroxybenzoate
    SMILES:  CCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: VFPFQHQNJCMNBZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3
    Synonyms: ETHYL GALLATE|831-61-8|Ethyl 3,4,5-trihydroxybenzoate|Gallic acid ethyl ester|Phyllemblin|Nipagallin A|Ethylgallate|P...
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  7. Dodecyl gallate
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 1166-52-5
    Formula:  C19H30O5        Molecular Weight: 338.44
    IUPAC Name:  dodecyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: RPWFJAMTCNSJKK-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H30O5/c1-2-3-4-5-6-7-8-9-10-11-12-24-19(23)15-13-16(20)18(22)17(21)14-15/h13-14,20-22H,2-12H2,1H3
    Synonyms: Dodecyl gallate|Lauryl gallate|1166-52-5|Dodecyl 3,4,5-trihydroxybenzoate|Nipagallin LA|Progallin LA|Gallic acid, dod...
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  8. Butyl Gallate
      Grade & Purity: 
    • ≥98%
    Cas Number: 1083-41-6
    Formula:  C11H14O5        Molecular Weight: 226.23
    IUPAC Name:  butyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: XOPOEBVTQYAOSV-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H14O5/c1-2-3-4-16-11(15)7-5-8(12)10(14)9(13)6-7/h5-6,12-14H,2-4H2,1H3
    Synonyms: Butylester kyseliny gallove | Gallic acid, butyl ester | HMS1577L19 | Progallin butyl | EINECS 214-107-7 | CCG-305745...
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  9. Ethyl gallate
      Grade & Purity: 
    • ≥99%(LC)(T)
    • For determination of the total content of polyphenols
    Cas Number: 831-61-8        EC Number: 212-608-5
    Formula:  C9H10O5        Molecular Weight: 198.17
    IUPAC Name:  ethyl 3,4,5-trihydroxybenzoate
    SMILES:  CCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: VFPFQHQNJCMNBZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H10O5/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4,10-12H,2H2,1H3
    Synonyms: DTXSID2061195 | Ethyl gallate, antioxidant, >=96.0% (HPLC) | Benzoic acid, 3,4,5-trihydroxy-, ethyl ester | AC-11363 ...
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  10. Octyl gallate
    Cas Number: 1034-01-1        EC Number: 213-853-0
    Formula:  C15H22O5        Molecular Weight: 282.33
    IUPAC Name:  octyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: NRPKURNSADTHLJ-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H22O5/c1-2-3-4-5-6-7-8-20-15(19)11-9-12(16)14(18)13(17)10-11/h9-10,16-18H,2-8H2,1H3
    Synonyms: DTXCID2020713 | octyl 3,4,5-trihydroxybenzoate;Octyl gallate | 4-10-00-02005 (Beilstein Handbook Reference) | Octyl g...
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  11. Hamamelitannin
      Grade & Purity: 
    • ≥98%
    Cas Number: 469-32-9        EC Number: 207-416-3
    Formula:  C20H20O14        Molecular Weight: 484.36
    IUPAC Name:  [(2S,3S,4S)-3,4,5-trihydroxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate
    SMILES:  C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O
    InChIKey: FEPAFOYQTIEEIS-WZKFEGCESA-N
    InChI:  InChI=1S/C20H20O14/c21-9-1-7(2-10(22)14(9)25)17(28)32-5-13-16(27)20(31,19(30)34-13)6-33-18(29)8-3-11(23)15(26)12(24)4-8/h1-4,13,16,19,21-27,30-31H,5-6show more
    Synonyms: Hamamelitannin | hamamelitanin | [(2S,3S,4S)-3,4,5-trihydroxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methy...
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  12. Propyl gallate
    Cas Number: 121-79-9        EC Number: 204-498-2
    Formula:  C10H12O5        Molecular Weight: 212.2
    IUPAC Name:  propyl 3,4,5-trihydroxybenzoate
    SMILES:  CCCOC(=O)C1=CC(=C(C(=C1)O)O)O
    InChIKey: ZTHYODDOHIVTJV-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3
    Synonyms: CAS-121-79-9 | n-Propyl 3,5-trihydroxybenzoate | PROPYL GALLATE [II] | CBDivE_013134 | INS NO.310 | PROPYL GALLATE [E...
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