2-Heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]benzoic acid

CAS Registry Number®

529-56-6

CAS Name

2-Heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]benzoic acid

Molecular Formula

C23H28O7

Molecular Mass

416.46

Cite this Page

2-Heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=529-56-6 (retrieved 2024-11-22) (CAS RN: 529-56-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    140 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H28O7/c1-4-5-6-7-8-9-15-11-17(13-19(25)21(15)22(26)27)30-23(28)20-14(2)10-16(29-3)12-18(20)24/h10-13,24-25H,4-9H2,1-3H3,(H,26,27)

InChIKey

InChIKey=LNAYIVMXSQCRRC-UHFFFAOYSA-N

SMILES

C(CCCCCC)C1=C(C(O)=O)C(O)=CC(OC(=O)C2=C(C)C=C(OC)C=C2O)=C1

Canonical SMILES

O=C(O)C1=C(O)C=C(OC(=O)C2=C(O)C=C(OC)C=C2C)C=C1CCCCCCC

Other Names for this Substance

  • Benzoic acid, 2-heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]-
  • 2,6-Cresotic acid, 4-methoxy-, 4-ester with 6-heptyl-β-resorcylic acid
  • Spherophorin
  • 2-Heptyl-6-hydroxy-4-[(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy]benzoic acid
  • Sphaerophorin

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration