U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H14N2O.C4H6O6
Molecular Weight 400.382
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SGB-017 (-)-TARTRATE

SMILES

O[C@@H]([C@H](O)C(O)=O)C(O)=O.NC(=O)[C@@]12N[C@@H](CC3=C1C=CC=C3)C4=CC=CC=C24

InChI

InChIKey=XJNFQUNVUAQFGV-YFHNVSOGSA-N
InChI=1S/C16H14N2O.C4H6O6/c17-15(19)16-12-7-3-1-5-10(12)9-14(18-16)11-6-2-4-8-13(11)16;5-1(3(7)8)2(6)4(9)10/h1-8,14,18H,9H2,(H2,17,19);1-2,5-6H,(H,7,8)(H,9,10)/t14-,16+;1-,2-/m00/s1

HIDE SMILES / InChI

Molecular Formula C4H6O6
Molecular Weight 150.0868
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C16H14N2O
Molecular Weight 250.2952
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 Fri Dec 15 15:37:44 GMT 2023
Edited
by admin
on Fri Dec 15 15:37:44 GMT 2023
Record UNII
M4UJ2P3ASZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SGB-017 (-)-TARTRATE
Code English
10,11-DIHYDRO-5H-DIBENZO(A,D)CYCLOHEPTEN-5,10-IMINE-5-CARBOXAMIDE TARTRATE, 5R,10S, D-
Common Name English
5H-DIBENZO(A,D)CYCLOHEPTEN-5,10-IMINE-5-CARBOXAMIDE, 10,11-DIHYDRO-, (5R-CIS)-, (S-(R*,R*))-2,3-DIHYDROXYBUTANEDIOATE (1:1)
Common Name English
Code System Code Type Description
CAS
184046-15-9
Created by admin on Fri Dec 15 15:37:45 GMT 2023 , Edited by admin on Fri Dec 15 15:37:45 GMT 2023
PRIMARY
PUBCHEM
138454948
Created by admin on Fri Dec 15 15:37:45 GMT 2023 , Edited by admin on Fri Dec 15 15:37:45 GMT 2023
PRIMARY
FDA UNII
M4UJ2P3ASZ
Created by admin on Fri Dec 15 15:37:45 GMT 2023 , Edited by admin on Fri Dec 15 15:37:45 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE