Enterodiol

CAS Registry Number®

80226-00-2
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CAS Name

Enterodiol

Molecular Formula

C18H22O4

Molecular Mass

302.36

Cite this Page

Enterodiol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=80226-00-2 (retrieved 2024-04-25) (CAS RN: 80226-00-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H22O4/c19-11-15(7-13-3-1-5-17(21)9-13)16(12-20)8-14-4-2-6-18(22)10-14/h1-6,9-10,15-16,19-22H,7-8,11-12H2/t15-,16-/m0/s1

InChIKey

InChIKey=DWONJCNDULPHLV-HOTGVXAUSA-N

SMILES

[C@H]([C@@H](CC1=CC(O)=CC=C1)CO)(CC2=CC(O)=CC=C2)CO

Canonical SMILES

OC1=CC=CC(=C1)CC(CO)C(CO)CC=2C=CC=C(O)C2

Other Names for this Substance

  • 1,4-Butanediol, 2,3-bis[(3-hydroxyphenyl)methyl]-, (2R,3R)-
  • 1,4-Butanediol, 2,3-bis[(3-hydroxyphenyl)methyl]-, [R-(R*,R*)]-
  • (2R,3R)-2,3-Bis[(3-hydroxyphenyl)methyl]-1,4-butanediol
  • Enterodiol
  • (-)-Enterodiol

Deleted or Replaced CAS Registry Numbers

81495-77-4

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