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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H20N2O7
Molecular Weight 412.3927
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-DEOXY-1-((5H-DIBENZ(B,F)AZEPIN-5-YLCARBONYL)AMINO)-.BETA.-D-GLUCOPYRANURONIC ACID

SMILES

O[C@H]1[C@H](NC(=O)N2C3=C(C=CC=C3)C=CC4=C2C=CC=C4)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O

InChI

InChIKey=VKZWFMGCAPKSML-QXCZDIPSSA-N
InChI=1S/C21H20N2O7/c24-15-16(25)18(20(27)28)30-19(17(15)26)22-21(29)23-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)23/h1-10,15-19,24-26H,(H,22,29)(H,27,28)/t15-,16-,17+,18-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H20N2O7
Molecular Weight 412.3927
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:43:40 UTC 2023
Edited
by admin
on Sat Dec 16 14:43:40 UTC 2023
Record UNII
FRX2CL2J2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-DEOXY-1-((5H-DIBENZ(B,F)AZEPIN-5-YLCARBONYL)AMINO)-.BETA.-D-GLUCOPYRANURONIC ACID
Systematic Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-DEOXY-1-((5H-DIBENZ(B,F)AZEPIN-5-YLCARBONYL)AMINO)-
Systematic Name English
CARBAMAZEPINE N-GLUCURONIDE
Common Name English
Code System Code Type Description
FDA UNII
FRX2CL2J2P
Created by admin on Sat Dec 16 14:43:40 UTC 2023 , Edited by admin on Sat Dec 16 14:43:40 UTC 2023
PRIMARY
PUBCHEM
21115954
Created by admin on Sat Dec 16 14:43:40 UTC 2023 , Edited by admin on Sat Dec 16 14:43:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID10975750
Created by admin on Sat Dec 16 14:43:40 UTC 2023 , Edited by admin on Sat Dec 16 14:43:40 UTC 2023
PRIMARY
CAS
60342-79-2
Created by admin on Sat Dec 16 14:43:40 UTC 2023 , Edited by admin on Sat Dec 16 14:43:40 UTC 2023
PRIMARY
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