AR-C133913XX

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C14H22N6O4S
Molecular Weight	370.427
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCSC1=NC2=C(N=NN2[C@@H]3C[C@H](OCCO)[C@@H](O)[C@H]3O)C(N)=N1

InChI

InChIKey=YTYBSYIHUFBLKV-YKDSUIRESA-N

InChI=1S/C14H22N6O4S/c1-2-5-25-14-16-12(15)9-13(17-14)20(19-18-9)7-6-8(24-4-3-21)11(23)10(7)22/h7-8,10-11,21-23H,2-6H2,1H3,(H2,15,16,17)/t7-,8+,10+,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C14H22N6O4S
Molecular Weight	370.427
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:22:20 GMT 2023` Edited by `admin` on `Sat Dec 16 09:22:20 GMT 2023`
Record UNII	LNY396KYTZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AR-C133913XX

Common Name

English

(1S,2S,3R,5S)-3-(7-AMINO-5-PROPYLSULFANYLTRIAZOLO(4,5-D)PYRIMIDIN-3-YL)-5-(2-HYDROXYETHOXY)CYCLOPENTANE-1,2-DIOL

Systematic Name

English

AR-C 133913XX

Code

English

TICAGRELOR METABOLITE M5

Common Name

English

1,2-CYCLOPENTANEDIOL, 3-(7-AMINO-5-(PROPYLTHIO)-3H-1,2,3-TRIAZOLO(4,5-D)PYRIMIDIN-3-YL)-5-(2-HYDROXYETHOXY)-, (1S,2S,3R,5S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

LNY396KYTZ

Created by admin on Sat Dec 16 09:22:21 GMT 2023 , Edited by admin on Sat Dec 16 09:22:21 GMT 2023

PRIMARY

PUBCHEM

78358176

Created by admin on Sat Dec 16 09:22:21 GMT 2023 , Edited by admin on Sat Dec 16 09:22:21 GMT 2023

PRIMARY

CAS

1251765-07-7

Created by admin on Sat Dec 16 09:22:20 GMT 2023 , Edited by admin on Sat Dec 16 09:22:20 GMT 2023

PRIMARY

Related Record Type Details


					GLH0314RVC

TICAGRELOR

PARENT -> METABOLITE

Interaction Type:

MAJOR

Qualification:

URINE