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Details

Stereochemistry RACEMIC
Molecular Formula C27H28O3
Molecular Weight 400.5094
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-((6-ETHYL-11,12-DIHYDRO-5-PHENYLDIBENZO(A,E)CYCLOOCTEN-2-YL)OXY)-1,2-PROPANEDIOL

SMILES

CCC1=C(C2=CC=CC=C2)C3=C(CCC4=C1C=CC=C4)C=C(OCC(O)CO)C=C3

InChI

InChIKey=PWNFKFQZMLZBNA-PNHLSOANSA-N
InChI=1S/C27H28O3/c1-2-24-25-11-7-6-8-19(25)12-13-21-16-23(30-18-22(29)17-28)14-15-26(21)27(24)20-9-4-3-5-10-20/h3-11,14-16,22,28-29H,2,12-13,17-18H2,1H3/b27-24-

HIDE SMILES / InChI

Molecular Formula C27H28O3
Molecular Weight 400.5094
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:09:51 GMT 2023
Edited
by admin
on Sat Dec 16 08:09:51 GMT 2023
Record UNII
372FQS0UEH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-((6-ETHYL-11,12-DIHYDRO-5-PHENYLDIBENZO(A,E)CYCLOOCTEN-2-YL)OXY)-1,2-PROPANEDIOL
Systematic Name English
1,2-PROPANEDIOL, 3-((6-ETHYL-5-PHENYL-11,12-DIHYDRODIBENZO(A,E)CYCLOOCTEN-2-YL)OXY)-
Systematic Name English
Code System Code Type Description
FDA UNII
372FQS0UEH
Created by admin on Sat Dec 16 08:09:51 GMT 2023 , Edited by admin on Sat Dec 16 08:09:51 GMT 2023
PRIMARY
PUBCHEM
3070122
Created by admin on Sat Dec 16 08:09:51 GMT 2023 , Edited by admin on Sat Dec 16 08:09:51 GMT 2023
PRIMARY
CAS
85850-91-5
Created by admin on Sat Dec 16 08:09:51 GMT 2023 , Edited by admin on Sat Dec 16 08:09:51 GMT 2023
PRIMARY