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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O4
Molecular Weight 347.4631
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-CARBOXY-11-NOR-.DELTA.8-TETRAHYDROCANNABINOL, (PENTYL-5,5,5-D3)-

SMILES

[H][C@@]12CC(=CC[C@@]1([H])C(C)(C)OC3=C2C(O)=CC(CCCCC([2H])([2H])[2H])=C3)C(O)=O

InChI

InChIKey=OGXXAQFMAFTSRU-FWHYEAKOSA-N
InChI=1S/C21H28O4/c1-4-5-6-7-13-10-17(22)19-15-12-14(20(23)24)8-9-16(15)21(2,3)25-18(19)11-13/h8,10-11,15-16,22H,4-7,9,12H2,1-3H3,(H,23,24)/t15-,16-/m1/s1/i1D3

HIDE SMILES / InChI

Molecular Formula C21H28O4
Molecular Weight 347.4631
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:25:45 GMT 2023
Edited
by admin
on Fri Dec 15 15:25:45 GMT 2023
Record UNII
VS9EG38QPG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-CARBOXY-11-NOR-.DELTA.8-TETRAHYDROCANNABINOL, (PENTYL-5,5,5-D3)-
Common Name English
(-)-11-nor-9-carboxy-Δ8-THC-d3
Common Name English
11-nor-9-carboxy-Δ8-THC-d3, (-)-
Common Name English
(6AR,10AR)-6A,7,8,10A-TETRAHYDRO-1-HYDROXY-6,6-DIMETHYL-3-(PENTYL-5,5,5-D3)-6H-DIBENZO(B,D)PYRAN-9-CARBOXYLIC ACID
Systematic Name English
6H-Dibenzo[b,d]pyran-9-carboxylic acid, 6a,7,10,10a-tetrahydro-1-hydroxy-6,6-dimethyl-3-(pentyl-5,5,5-d3)-, (6aR,10aR)-
Systematic Name English
Code System Code Type Description
CAS
949596-06-9
Created by admin on Fri Dec 15 15:25:45 GMT 2023 , Edited by admin on Fri Dec 15 15:25:45 GMT 2023
PRIMARY
PUBCHEM
168322721
Created by admin on Fri Dec 15 15:25:45 GMT 2023 , Edited by admin on Fri Dec 15 15:25:45 GMT 2023
PRIMARY
FDA UNII
VS9EG38QPG
Created by admin on Fri Dec 15 15:25:45 GMT 2023 , Edited by admin on Fri Dec 15 15:25:45 GMT 2023
PRIMARY
Related Record Type Details
NON-LABELED -> LABELED