Benzoic acid, 2-hydroxy-6-methyl-, 5,6-dihydroxy-3-(hydroxymethyl)-2-oxo-3-cyclohexen-1-yl ester, [1S-(1α,5β,6β)]-

CAS Registry Number®

146475-71-0

CAS Name

Benzoic acid, 2-hydroxy-6-methyl-, 5,6-dihydroxy-3-(hydroxymethyl)-2-oxo-3-cyclohexen-1-yl ester, [1S-(1α,5β,6β)]-

Molecular Formula

C15H16O7

Molecular Mass

308.28

Cite this Page

Benzoic acid, 2-hydroxy-6-methyl-, 5,6-dihydroxy-3-(hydroxymethyl)-2-oxo-3-cyclohexen-1-yl ester, [1S-(1α,5β,6β)]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=146475-71-0 (retrieved 2024-11-22) (CAS RN: 146475-71-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H16O7/c1-7-3-2-4-9(17)11(7)15(21)22-14-12(19)8(6-16)5-10(18)13(14)20/h2-5,10,13-14,16-18,20H,6H2,1H3/t10-,13-,14-/m1/s1

InChIKey

InChIKey=ZJIDZZXKQOJXMR-LERXQTSPSA-N

SMILES

C(O[C@@H]1C(=O)C(CO)=C[C@@H](O)[C@H]1O)(=O)C2=C(C)C=CC=C2O

Canonical SMILES

O=C(OC1C(=O)C(=CC(O)C1O)CO)C=2C(O)=CC=CC2C

Other Names for this Substance

  • Benzoic acid, 2-hydroxy-6-methyl-, 5,6-dihydroxy-3-(hydroxymethyl)-2-oxo-3-cyclohexen-1-yl ester, [1S-(1α,5β,6β)]-

CAS INSIGHTSTM
Targeted protein degrader structure, illustration