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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H29FIN5O9
Molecular Weight 749.4822
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESACETYL TRAMETINIB N-GLUCORONIDE

SMILES

CN1C(=O)C(C)=C2N(C(=O)N(C3CC3)C(=O)C2=C1NC4=CC=C(I)C=C4F)C5=CC(N[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(O)=O)=CC=C5

InChI

InChIKey=WRGITVKZJKFSRR-TYUWDEHNSA-N
InChI=1S/C30H29FIN5O9/c1-12-20-19(25(35(2)27(12)41)34-18-9-6-13(32)10-17(18)31)28(42)37(15-7-8-15)30(45)36(20)16-5-3-4-14(11-16)33-26-23(40)21(38)22(39)24(46-26)29(43)44/h3-6,9-11,15,21-24,26,33-34,38-40H,7-8H2,1-2H3,(H,43,44)/t21-,22-,23+,24-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H29FIN5O9
Molecular Weight 749.4822
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 10:09:13 GMT 2023
Edited
by admin
on Sat Dec 16 10:09:13 GMT 2023
Record UNII
5UXK6B3I2K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESACETYL TRAMETINIB N-GLUCORONIDE
Common Name English
TRAMETINIB METABOLITE M6
Common Name English
TRAMETINIB METABOLITE M2
Common Name English
TRAMETINIB, DESACETYL-, N-GLUCORONIDE-
Common Name English
Code System Code Type Description
FDA UNII
5UXK6B3I2K
Created by admin on Sat Dec 16 10:09:13 GMT 2023 , Edited by admin on Sat Dec 16 10:09:13 GMT 2023
PRIMARY
PUBCHEM
119025788
Created by admin on Sat Dec 16 10:09:13 GMT 2023 , Edited by admin on Sat Dec 16 10:09:13 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE
AMOUNT ADMINISTERED
PLASMA