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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H12F3IN2O4
Molecular Weight 480.1772
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-SERINE, N-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-

SMILES

OC[C@H](NC(=O)C1=C(NC2=CC=C(I)C=C2F)C(F)=C(F)C=C1)C(O)=O

InChI

InChIKey=IJXUCUDESMUVKY-LBPRGKRZSA-N
InChI=1S/C16H12F3IN2O4/c17-9-3-2-8(15(24)22-12(6-23)16(25)26)14(13(9)19)21-11-4-1-7(20)5-10(11)18/h1-5,12,21,23H,6H2,(H,22,24)(H,25,26)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H12F3IN2O4
Molecular Weight 480.1772
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:52:20 GMT 2023
Edited
by admin
on Sat Dec 16 14:52:20 GMT 2023
Record UNII
YXZ9926HUV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-SERINE, N-(3,4-DIFLUORO-2-((2-FLUORO-4-IODOPHENYL)AMINO)BENZOYL)-
Systematic Name English
COBIMETINIB METABOLITE M63WQ
Common Name English
Code System Code Type Description
CAS
1678516-77-2
Created by admin on Sat Dec 16 14:52:20 GMT 2023 , Edited by admin on Sat Dec 16 14:52:20 GMT 2023
PRIMARY
FDA UNII
YXZ9926HUV
Created by admin on Sat Dec 16 14:52:20 GMT 2023 , Edited by admin on Sat Dec 16 14:52:20 GMT 2023
PRIMARY
PUBCHEM
117962892
Created by admin on Sat Dec 16 14:52:20 GMT 2023 , Edited by admin on Sat Dec 16 14:52:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE