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Details

Stereochemistry RACEMIC
Molecular Formula C17H14O6
Molecular Weight 314.2895
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PISATIN, (±)-

SMILES

COC1=CC=C2[C@@H]3OC4=CC5=C(OCO5)C=C4[C@]3(O)COC2=C1

InChI

InChIKey=LZMRDTLRSDRUSU-DLBZAZTESA-N
InChI=1S/C17H14O6/c1-19-9-2-3-10-12(4-9)20-7-17(18)11-5-14-15(22-8-21-14)6-13(11)23-16(10)17/h2-6,16,18H,7-8H2,1H3/t16-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H14O6
Molecular Weight 314.2895
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 Mon Mar 31 23:09:40 GMT 2025
Edited
by admin
on Mon Mar 31 23:09:40 GMT 2025
Record UNII
N4PE9U3RE5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PISATIN, (±)-
Common Name English
(±)-PISATIN
Preferred Name English
6H-(1,3)DIOXOLO(5,6)BENZOFURO(3,2-C)(1)BENZOPYRAN-6A(12AH)-OL, 3-METHOXY-, (6AR,12AR)-REL-
Systematic Name English
6H-(1,3)DIOXOLO(5,6)BENZOFURO(3,2-C)(1)BENZOPYRAN-6A(12AH)-OL, 3-METHOXY-, CIS-(±)-
Systematic Name English
Code System Code Type Description
CAS
3187-47-1
Created by admin on Mon Mar 31 23:09:40 GMT 2025 , Edited by admin on Mon Mar 31 23:09:40 GMT 2025
PRIMARY
WIKIPEDIA
Pisatin
Created by admin on Mon Mar 31 23:09:40 GMT 2025 , Edited by admin on Mon Mar 31 23:09:40 GMT 2025
PRIMARY
FDA UNII
N4PE9U3RE5
Created by admin on Mon Mar 31 23:09:40 GMT 2025 , Edited by admin on Mon Mar 31 23:09:40 GMT 2025
PRIMARY