4-Carboxy-3-methoxy-2,5,6-trimethylphenyl 4-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-2-methoxy-3,5,6-trimethylbenzoate

CAS Registry Number®

71950-67-9

CAS Name

4-Carboxy-3-methoxy-2,5,6-trimethylphenyl 4-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-2-methoxy-3,5,6-trimethylbenzoate

Molecular Formula

C31H34O10

Molecular Mass

566.60

Cite this Page

4-Carboxy-3-methoxy-2,5,6-trimethylphenyl 4-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-2-methoxy-3,5,6-trimethylbenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71950-67-9 (retrieved 2024-11-24) (CAS RN: 71950-67-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H34O10/c1-12-11-20(32)17(6)24(33)21(12)30(36)40-26-16(5)14(3)23(28(39-10)19(26)8)31(37)41-25-15(4)13(2)22(29(34)35)27(38-9)18(25)7/h11,32-33H,1-10H3,(H,34,35)

InChIKey

InChIKey=UULGWGARYDGVBM-UHFFFAOYSA-N

SMILES

C(OC1=C(C)C(OC)=C(C(O)=O)C(C)=C1C)(=O)C2=C(OC)C(C)=C(OC(=O)C3=C(O)C(C)=C(O)C=C3C)C(C)=C2C

Canonical SMILES

O=C(O)C=1C(OC)=C(C(OC(=O)C=2C(OC)=C(C(OC(=O)C3=C(O)C(=C(O)C=C3C)C)=C(C2C)C)C)=C(C1C)C)C

Other Names for this Substance

  • Benzoic acid, 4-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-2-methoxy-3,5,6-trimethyl-, 4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
  • 4-Carboxy-3-methoxy-2,5,6-trimethylphenyl 4-[(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy]-2-methoxy-3,5,6-trimethylbenzoate
  • Thielavin B

CAS INSIGHTSTM
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