1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE, GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H29FIN5O10
Molecular Weight	765.4816
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE, GLUCURONIDE

Structure Search

SMILES

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

InChI

InChIKey=IGXOTSIHRCCVJX-ZHOCNHIISA-N

InChI=1S/C30H29FIN5O10/c1-11-20-19(25(35(2)26(11)41)34-17-7-3-12(32)9-15(17)31)27(42)37(13-4-5-13)30(45)36(20)14-6-8-18(16(33)10-14)46-29-23(40)21(38)22(39)24(47-29)28(43)44/h3,6-10,13,21-24,29,34,38-40H,4-5,33H2,1-2H3,(H,43,44)/t21-,22-,23+,24-,29+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H29FIN5O10
Molecular Weight	765.4816
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 `Mon Mar 31 23:34:04 GMT 2025` Edited by `admin` on `Mon Mar 31 23:34:04 GMT 2025`
Record UNII	218N550XZ4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 2-AMINO-4-(3-CYCLOPROPYL-5-((2-FLUORO-4-IODOPHENYL)AMINO)-3,4,6,7-TETRAHYDRO-6,8-DIMETHYL-2,4,7-TRIOXOPYRIDO(4,3-D)PYRIMIDIN-1(2H)-YL)PHENYL

Preferred Name

English

1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE, GLUCURONIDE

Common Name

English

TRAMETINIB METABOLITE M4

Common Name

English

TRAMETINIB METABOLITE M9

Common Name

English

Code System Code Type Description

PUBCHEM

119025827

Created by admin on Mon Mar 31 23:34:04 GMT 2025 , Edited by admin on Mon Mar 31 23:34:04 GMT 2025

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CAS

1620017-28-8

Created by admin on Mon Mar 31 23:34:04 GMT 2025 , Edited by admin on Mon Mar 31 23:34:04 GMT 2025

PRIMARY

FDA UNII

218N550XZ4

Created by admin on Mon Mar 31 23:34:04 GMT 2025 , Edited by admin on Mon Mar 31 23:34:04 GMT 2025

PRIMARY

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