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Details

Stereochemistry RACEMIC
Molecular Formula C21H21NO6
Molecular Weight 383.3945
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

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

SMILES

[H][C@@]1(OC(=O)C2=C1C=CC3=C2OCO3)[C@@]4([H])N(C)CCC5=CC(OC)=C(OC)C=C45

InChI

InChIKey=SZDGAZFTAUFFQH-OALUTQOASA-N
InChI=1S/C21H21NO6/c1-22-7-6-11-8-15(24-2)16(25-3)9-13(11)18(22)19-12-4-5-14-20(27-10-26-14)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H21NO6
Molecular Weight 383.3945
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:10:10 GMT 2023
Edited
by admin
on Sat Dec 16 08:10:10 GMT 2023
Record UNII
X0E9NYY64D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADLUMINE, (±)-
Common Name English
(±)-ADLUMINE
Common Name English
FURO(3,4-E)-1,3-BENZODIOXOL-8(6H)-ONE, 6-((1R)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2-METHYL-1-ISOQUINOLINYL)-, (6R)-REL-
Systematic Name English
ADLUMINE DL-FORM [MI]
Common Name English
Code System Code Type Description
PUBCHEM
442155
Created by admin on Sat Dec 16 08:10:10 GMT 2023 , Edited by admin on Sat Dec 16 08:10:10 GMT 2023
PRIMARY
CAS
38184-69-9
Created by admin on Sat Dec 16 08:10:10 GMT 2023 , Edited by admin on Sat Dec 16 08:10:10 GMT 2023
PRIMARY
MERCK INDEX
m1425
Created by admin on Sat Dec 16 08:10:10 GMT 2023 , Edited by admin on Sat Dec 16 08:10:10 GMT 2023
PRIMARY Merck Index
FDA UNII
X0E9NYY64D
Created by admin on Sat Dec 16 08:10:10 GMT 2023 , Edited by admin on Sat Dec 16 08:10:10 GMT 2023
PRIMARY