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Details

Stereochemistry RACEMIC
Molecular Formula C22H30O4
Molecular Weight 358.4712
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6A,7,8,10A-TETRAHYDRO-1-HYDROXY-6,6,9-TRIMETHYL-3-PENTYL-6H-DIBENZO(B,D)PYRAN-4-CARBOXYLIC ACID, (6AR,10AR)-REL-

SMILES

CCCCCC1=C(C(O)=O)C2=C([C@@H]3C=C(C)CC[C@H]3C(C)(C)O2)C(O)=C1

InChI

InChIKey=VITZNDKHSIWPSR-HZPDHXFCSA-N
InChI=1S/C22H30O4/c1-5-6-7-8-14-12-17(23)19-15-11-13(2)9-10-16(15)22(3,4)26-20(19)18(14)21(24)25/h11-12,15-16,23H,5-10H2,1-4H3,(H,24,25)/t15-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H30O4
Molecular Weight 358.4712
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 Wed Apr 02 13:10:10 GMT 2025
Edited
by admin
on Wed Apr 02 13:10:10 GMT 2025
Record UNII
HM5P2JH2MN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6H-DIBENZO(B,D)PYRAN-4-CARBOXYLIC ACID, 6A,7,8,10A-TETRAHYDRO-1-HYDROXY-6,6,9-TRIMETHYL-3-PENTYL-, (6AR,10AR)-REL-
Preferred Name English
6A,7,8,10A-TETRAHYDRO-1-HYDROXY-6,6,9-TRIMETHYL-3-PENTYL-6H-DIBENZO(B,D)PYRAN-4-CARBOXYLIC ACID, (6AR,10AR)-REL-
Systematic Name English
Code System Code Type Description
CAS
2668292-62-2
Created by admin on Wed Apr 02 13:10:10 GMT 2025 , Edited by admin on Wed Apr 02 13:10:10 GMT 2025
PRIMARY
FDA UNII
HM5P2JH2MN
Created by admin on Wed Apr 02 13:10:10 GMT 2025 , Edited by admin on Wed Apr 02 13:10:10 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE