Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.3.3
Substance Class Chemical
Record UNII
564Y9872GJ
Record Status Validated (UNII)
Record Version
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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O4
Molecular Weight 302.3649
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0
Created by admin on Thu Apr 04 00:39:49 EDT 2019
Edited by admin on Thu Apr 04 00:39:49 EDT 2019
Structure of .DELTA.-9-TETRAHYDROCANNABIORCOLIC ACID B

Systematic Names:

  • None recorded
  • {{name}}

SMILES

CC1=C[C@@H]2[C@@H](CC1)C(C)(C)OC3=C(C(O)=O)C(C)=CC(O)=C23

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
Name Type Language References
.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 References
PUBCHEM
86567674
Created by admin on Thu Apr 04 00:39:49 EDT 2019 , Edited by admin on Thu Apr 04 00:39:49 EDT 2019
PRIMARY
Related Record Type Details References
PARENT -> CONSTITUENT ALWAYS PRESENT
Mediator Substance Details
none
Delta-9-tetrahydrocannabinol class
Created by admin on Thu Apr 04 00:39:49 EDT 2019 , Edited by admin on Thu Apr 04 00:39:49 EDT 2019
Created Thu Apr 04 00:39:49 EDT 2019
Created By admin
Last Edited Thu Apr 04 00:39:49 EDT 2019
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed
1 SRS import [564Y9872GJ] SRS NOMEN Fri Apr 28 15:14:10 EDT 2017
2 CHAPTER 2 : CHEMISTRY AND ANALYSIS OF PHYTOCANNABINOIDS AND OTHER CANNABIS CONSTITUENTS BY RUDOLF BRENNEISEN; PAGES 17-49 WEBSITE NOMEN
3 dump-public-2019-04-03.gsrs BATCH_IMPORT Thu Apr 04 00:39:49 EDT 2019
4 http://www.medicinalgenomics.com/wp-content/uploads/2011/12/Chemical-constituents-of-cannabis.pdf SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
5 SRS CODE IMPORT SRS NOMEN Fri Apr 28 15:14:10 EDT 2017
6 WEB PAGE WEB PAGE NOMEN

Molecular Formula C18H22O4
Molecular Weight 302.3649
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED