ROSCOVITINE CARBOXYLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H24N6O2
Molecular Weight	368.4329
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ROSCOVITINE CARBOXYLIC ACID

Structure Search

SMILES

CC[C@@H](NC1=NC2=C(N=CN2C(C)C)C(NCC3=CC=CC=C3)=N1)C(O)=O

InChI

InChIKey=MZLAEKOAINERGI-CQSZACIVSA-N

InChI=1S/C19H24N6O2/c1-4-14(18(26)27)22-19-23-16(20-10-13-8-6-5-7-9-13)15-17(24-19)25(11-21-15)12(2)3/h5-9,11-12,14H,4,10H2,1-3H3,(H,26,27)(H2,20,22,23,24)/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H24N6O2
Molecular Weight	368.4329
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 16:32:35 GMT 2023` Edited by `admin` on `Sat Dec 16 16:32:35 GMT 2023`
Record UNII	U78UW8Q3QQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ROSCOVITINE CARBOXYLIC ACID

Common Name

English

(2R)-2-((9-(1-METHYLETHYL)-6-((PHENYLMETHYL)AMINO)-9H-PURIN-2-YL)AMINO)BUTANOIC ACID

Systematic Name

English

BUTANOIC ACID, 2-((9-(1-METHYLETHYL)-6-((PHENYLMETHYL)AMINO)-9H-PURIN-2-YL)AMINO)-, (2R)-

Systematic Name

English

Code System Code Type Description

CAS

482615-12-3

Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023

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PUBCHEM

3013831

Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023

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FDA UNII

U78UW8Q3QQ

Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023

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