O-Desmethyl Tramadol β-D-Glucuronide(Mixture of Diastereomers)

For research use only. Not for therapeutic Use.

  • CAT Number: R011813
  • CAS Number: 383891-39-2
  • Molecular Formula: C21H31NO8
  • Molecular Weight: 425.478
  • Purity: ≥95%
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Catalog Number R011813
CAS Number 383891-39-2
Synonyms

3-[2-[(Dimethylamino)methyl]-1-hydroxycyclohexyl]phenyl β-D-Glucopyranosiduronic Acid;

Molecular Formula C21H31NO8
Purity ≥95%
Storage -20°C
IUPAC Name (2S,3S,4S,5R,6S)-6-[3-[2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI InChI=1S/C21H31NO8/c1-22(2)11-13-6-3-4-9-21(13,28)12-7-5-8-14(10-12)29-20-17(25)15(23)16(24)18(30-20)19(26)27/h5,7-8,10,13,15-18,20,23-25,28H,3-4,6,9,11H2,1-2H3,(H,26,27)/t13?,15-,16-,17+,18-,20+,21?/m0/s1
InChIKey DSBGQRZOJXSECT-VFUSOVNCSA-N
SMILES CN(C)CC1CCCCC1(C2=CC(=CC=C2)OC3C(C(C(C(O3)C(=O)O)O)O)O)O

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