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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21NO5
Molecular Weight 355.3844
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,7,8,15-Tetrahydro-4-hydroxy-3-methoxy-6-methyl[1,3]benzodioxolo[5,6-e][2]benzazecin-14(6H)-one

SMILES

COC1=CC=C2CC(=O)C3=C(CCN(C)CC2=C1O)C=C4OCOC4=C3

InChI

InChIKey=RSMSJQDBPYSXHH-UHFFFAOYSA-N
InChI=1S/C20H21NO5/c1-21-6-5-13-8-18-19(26-11-25-18)9-14(13)16(22)7-12-3-4-17(24-2)20(23)15(12)10-21/h3-4,8-9,23H,5-7,10-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H21NO5
Molecular Weight 355.3844
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:00:31 GMT 2023
Edited
by admin
on Sat Dec 16 12:00:31 GMT 2023
Record UNII
S9TC6BMK2V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,7,8,15-Tetrahydro-4-hydroxy-3-methoxy-6-methyl[1,3]benzodioxolo[5,6-e][2]benzazecin-14(6H)-one
Systematic Name English
Benzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one, 5,7,8,15-tetrahydro-4-hydroxy-3-methoxy-6-methyl-
Systematic Name English
[1,3]Benzodioxolo[5,6-e][2]benzazecin-14(6H)-one, 5,7,8,15-tetrahydro-4-hydroxy-3-methoxy-6-methyl-
Systematic Name English
5,7,8,15-Tetrahydro-4-hydroxy-3-methoxy-6-methylbenzo[c][1,3]benzodioxolo[5,6-g]azecin-14(6H)-one
Systematic Name English
Code System Code Type Description
CAS
490-52-8
Created by admin on Sat Dec 16 12:00:31 GMT 2023 , Edited by admin on Sat Dec 16 12:00:31 GMT 2023
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FDA UNII
S9TC6BMK2V
Created by admin on Sat Dec 16 12:00:31 GMT 2023 , Edited by admin on Sat Dec 16 12:00:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-711-7
Created by admin on Sat Dec 16 12:00:31 GMT 2023 , Edited by admin on Sat Dec 16 12:00:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID90197655
Created by admin on Sat Dec 16 12:00:31 GMT 2023 , Edited by admin on Sat Dec 16 12:00:31 GMT 2023
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PUBCHEM
1275589
Created by admin on Sat Dec 16 12:00:31 GMT 2023 , Edited by admin on Sat Dec 16 12:00:31 GMT 2023
PRIMARY