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Details

Stereochemistry RACEMIC
Molecular Formula C20H18O6
Molecular Weight 354.3533
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

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

SMILES

[H][C@]12CO[C@H](C3=CC=C4OCOC4=C3)[C@@]1([H])CO[C@H]2C5=CC=C6OCOC6=C5

InChI

InChIKey=PEYUIKBAABKQKQ-WZBLMQSHSA-N
InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H18O6
Molecular Weight 354.3533
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:18:39 UTC 2023
Edited
by admin
on Sat Dec 16 05:18:39 UTC 2023
Record UNII
F6PWY73ZGT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASARININ, (±)-
Common Name English
ASARININ DL-FORM [MI]
Common Name English
NSC-31773
Code English
1,3-BENZODIOXOLE, 5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, (1.ALPHA.,3A.ALPHA.,4.BETA.,6A.ALPHA.)-
Common Name English
1,3-BENZODIOXOLE, 5,5'-((1R,3AR,4S,6AR)-TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, REL-
Common Name English
Code System Code Type Description
WIKIPEDIA
Asarinin
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY
PUBCHEM
101612
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY
CAS
133-05-1
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY
NSC
31773
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY
MERCK INDEX
m2082
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY Merck Index
FDA UNII
F6PWY73ZGT
Created by admin on Sat Dec 16 05:18:39 UTC 2023 , Edited by admin on Sat Dec 16 05:18:39 UTC 2023
PRIMARY