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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H25N3O2.C4H6O6
Molecular Weight 501.5289
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISNORCYMSERINE TARTRATE

SMILES

O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@]12NCC[C@@]1(C)C3=C(N2)C=CC(OC(=O)NC4=CC=C(C=C4)C(C)C)=C3

InChI

InChIKey=VLBFBWKWLMBEPA-BNBZVHDBSA-N
InChI=1S/C21H25N3O2.C4H6O6/c1-13(2)14-4-6-15(7-5-14)23-20(25)26-16-8-9-18-17(12-16)21(3)10-11-22-19(21)24-18;5-1(3(7)8)2(6)4(9)10/h4-9,12-13,19,22,24H,10-11H2,1-3H3,(H,23,25);1-2,5-6H,(H,7,8)(H,9,10)/t19-,21+;1-,2-/m11/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 C21H25N3O2
Molecular Weight 351.4421
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 Sat Dec 16 09:11:21 GMT 2023
Edited
by admin
on Sat Dec 16 09:11:21 GMT 2023
Record UNII
Z2N8V30KGU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISNORCYMSERINE TARTRATE
Common Name English
CARBAMIC ACID, (4-(1-METHYLETHYL)PHENYL)-, (3AS,8AR)-1,2,3,3A,8,8A-HEXAHYDRO-3A-METHYLPYRROLO(2,3-B)INDOL-5-YL ESTER, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE
Systematic Name English
Code System Code Type Description
PUBCHEM
72941939
Created by admin on Sat Dec 16 09:11:21 GMT 2023 , Edited by admin on Sat Dec 16 09:11:21 GMT 2023
PRIMARY
FDA UNII
Z2N8V30KGU
Created by admin on Sat Dec 16 09:11:21 GMT 2023 , Edited by admin on Sat Dec 16 09:11:21 GMT 2023
PRIMARY
CAS
887028-62-8
Created by admin on Sat Dec 16 09:11:21 GMT 2023 , Edited by admin on Sat Dec 16 09:11:21 GMT 2023
PRIMARY
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