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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O4
Molecular Weight 302.3656
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .DELTA.-9-TETRAHYDROCANNABIORCOLIC ACID B

SMILES

CC1=C[C@]2([H])[C@@]([H])(CC1)C(C)(C)Oc3c(c(C)cc(c23)O)C(=O)O

InChI

InChIKey=FUIFGAFTCQIBQJ-VXGBXAGGSA-N
InChI=1S/C18H22O4/c1-9-5-6-12-11(7-9)15-13(19)8-10(2)14(17(20)21)16(15)22-18(12,3)4/h7-8,11-12,19H,5-6H2,1-4H3,(H,20,21)/t11-,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H22O4
Molecular Weight 302.3656
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 Sat Jun 26 13:12:11 UTC 2021
Edited
by admin
on Sat Jun 26 13:12:11 UTC 2021
Record UNII
564Y9872GJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.DELTA.-9-TETRAHYDROCANNABIORCOLIC ACID B
Common Name English
THCA-C1 B
Code English
(6AR,10AR)-1-HYDROXY-3,6,6,9-TETRAMETHYL-6A,7,8,10A-TETRAHYDRO-6H-BENZO(C)CHROMENE-4-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
86567674
Created by admin on Sat Jun 26 13:12:11 UTC 2021 , Edited by admin on Sat Jun 26 13:12:11 UTC 2021
PRIMARY
FDA UNII
564Y9872GJ
Created by admin on Sat Jun 26 13:12:11 UTC 2021 , Edited by admin on Sat Jun 26 13:12:11 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Delta-9-tetrahydrocannabinol class