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Substance Name: delta(sup 8)-Tetrahydrocannabinol glucuronide sodium salt
RN: 74282-36-3
InChIKey: PBYNGHYHXQXNGS-REODJRSFSA-N

Molecular Formula

  • C27-H38-O8.Na.3H2-O

Molecular Weight

  • 512.5713
 
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Names and Synonyms

Results Name

  • delta(sup 8)-Tetrahydrocannabinol glucuronide sodium salt

Synonym

  • delta(sup 8)-Tetrahydrocannabinol glucuronide sodium salt

Systematic Name

  • beta-D-Glucopyranosiduronic acid, 6a,7,10,10a-tetrahydro-6,6,9-trimethyl-3-pentyl-6H-dibenzo(b,d)pyran-1-yl-, monosodium salt, trihydrate, (6aR-trans)-

Registry Numbers

CAS Registry Number

  • 74282-36-3

System Generated Number

  • 0074282363

Molecular Formulas

Molecular Formula

  • C27-H38-O8.Na.3H2-O

Molecular Formula Fragments

  • C27-H38-O8
  • COMPONENT
  • H2-O
  • Na

Structure Descriptors

InChI

1S/C27H37O8.Na/c1-5-6-7-13-27(31)22(28)24(26(3,30)32-4)35-25(23(27)29)34-20-10-8-9-19-21(20)18-14-16(2)11-12-17(18)15-33-19;/h8-12,14,17-18,22-25,28,30-31H,5-7,13,15H2,1-4H3;/q-1;+1/t17-,18+,22+,23-,24-,25+,26?,27-;/m0./s1

InChIKey

PBYNGHYHXQXNGS-REODJRSFSA-N

Smiles

CCCCC[C@@]1([C@@H]([C@H](O[C@H]([C@@H]1[O-])Oc2cccc3c2[C@@H]4C=C(C=C[C@H]4CO3)C)C(C)(O)OC)O)O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 50mg/kg (50mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 27, Pg. 3009, 1979.