rel-(+)-Methyl (1R,2S,3S)-3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-1H-indene-1-acetate

CAS Registry Number®

191280-20-3

CAS Name

rel-(+)-Methyl (1R,2S,3S)-3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-1H-indene-1-acetate

Molecular Formula

C20H20O8

Molecular Mass

388.37

Cite this Page

rel-(+)-Methyl (1R,2S,3S)-3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-1H-indene-1-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=191280-20-3 (retrieved 2024-11-24) (CAS RN: 191280-20-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H20O8/c1-27-17(25)8-12-10-6-15(23)16(24)7-11(10)18(19(12)20(26)28-2)9-3-4-13(21)14(22)5-9/h3-7,12,18-19,21-24H,8H2,1-2H3/t12-,18-,19-/m0/s1

InChIKey

InChIKey=CWIZKMYGNOEFKO-NXXSPTCGSA-N

SMILES

C(OC)(=O)[C@@H]1[C@H](C=2C([C@@H]1CC(OC)=O)=CC(O)=C(O)C2)C3=CC(O)=C(O)C=C3

Canonical SMILES

O=C(OC)CC1C2=CC(O)=C(O)C=C2C(C3=CC=C(O)C(O)=C3)C1C(=O)OC

Other Names for this Substance

  • 1H-Indene-1-acetic acid, 3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-, methyl ester, (1R,2S,3S)-rel-(+)-
  • 1H-Indene-1-acetic acid, 3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-, methyl ester, (1α,2α,3β)-(+)-
  • rel-(+)-Methyl (1R,2S,3S)-3-(3,4-dihydroxyphenyl)-2,3-dihydro-5,6-dihydroxy-2-(methoxycarbonyl)-1H-indene-1-acetate

CAS INSIGHTSTM
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