GSK-2245035 MALEATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H34N6O2.C4H4O4
Molecular Weight	506.5951
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CCC[C@H](C)OC1=NC(N)=C2NC(=O)N(CCCCCN3CCCCC3)C2=N1

InChI

InChIKey=MWVXFHFYGZBEBN-DASCVMRKSA-N

InChI=1S/C20H34N6O2.C4H4O4/c1-3-10-15(2)28-19-23-17(21)16-18(24-19)26(20(27)22-16)14-9-5-8-13-25-11-6-4-7-12-25;5-3(6)1-2-4(7)8/h15H,3-14H2,1-2H3,(H,22,27)(H2,21,23,24);1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C20H34N6O2
Molecular Weight	390.523
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:21:39 UTC 2023` Edited by `admin` on `Sat Dec 16 14:21:39 UTC 2023`
Record UNII	P7H1142RHT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GSK-2245035 MALEATE

Code

English

8H-PURIN-8-ONE, 6-AMINO-7,9-DIHYDRO-2-((1S)-1-METHYLBUTOXY)-9-(5-(1-PIPERIDINYL)PENTYL)-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

GSK-2245035 MALEATE SALT

Code

English

Code System Code Type Description

CAS

1325212-97-2

Created by admin on Sat Dec 16 14:21:40 UTC 2023 , Edited by admin on Sat Dec 16 14:21:40 UTC 2023

PRIMARY

PUBCHEM

53342522

Created by admin on Sat Dec 16 14:21:40 UTC 2023 , Edited by admin on Sat Dec 16 14:21:40 UTC 2023

PRIMARY

FDA UNII

P7H1142RHT

Created by admin on Sat Dec 16 14:21:40 UTC 2023 , Edited by admin on Sat Dec 16 14:21:40 UTC 2023

PRIMARY

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ACTIVE MOIETY