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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H19N5O.C3H4O4
Molecular Weight 389.4057
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RITLECITINIB MALONATE

SMILES

OC(=O)CC(O)=O.C[C@H]1CC[C@H](CN1C(=O)C=C)NC2=C3C=CNC3=NC=N2

InChI

InChIKey=QMPMPSGDPRHZCG-VZXYPILPSA-N
InChI=1S/C15H19N5O.C3H4O4/c1-3-13(21)20-8-11(5-4-10(20)2)19-15-12-6-7-16-14(12)17-9-18-15;4-2(5)1-3(6)7/h3,6-7,9-11H,1,4-5,8H2,2H3,(H2,16,17,18,19);1H2,(H,4,5)(H,6,7)/t10-,11+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C15H19N5O
Molecular Weight 285.3443
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C3H4O4
Molecular Weight 104.0615
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:04:27 UTC 2023
Edited
by admin
on Sat Dec 16 09:04:27 UTC 2023
Record UNII
132LF5WGH4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RITLECITINIB MALONATE
Common Name English
1-((2S,5R)-2-METHYL-5-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLAMINO)-1-PIPERIDINYL)-2-PROPEN-1-ONE MALONATE
Systematic Name English
PROPANEDIOIC ACID, COMPD. WITH 1-((2S,5R)-2-METHYL-5-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLAMINO)-1-PIPERIDINYL)-2-PROPEN-1-ONE (1:1)
Systematic Name English
PF-06651600 MALONATE
Code English
Code System Code Type Description
PUBCHEM
124203830
Created by admin on Sat Dec 16 09:04:28 UTC 2023 , Edited by admin on Sat Dec 16 09:04:28 UTC 2023
PRIMARY
FDA UNII
132LF5WGH4
Created by admin on Sat Dec 16 09:04:28 UTC 2023 , Edited by admin on Sat Dec 16 09:04:28 UTC 2023
PRIMARY
CAS
2140301-97-7
Created by admin on Sat Dec 16 09:04:28 UTC 2023 , Edited by admin on Sat Dec 16 09:04:28 UTC 2023
PRIMARY
SMS_ID
300000045439
Created by admin on Sat Dec 16 09:04:28 UTC 2023 , Edited by admin on Sat Dec 16 09:04:28 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY