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Details

Stereochemistry UNKNOWN
Molecular Formula C17H18N6O
Molecular Weight 322.3644
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INCB-27598

SMILES

OC1CCC[C@H]1[C@@H](CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3

InChI

InChIKey=YIOHYHBNMPEYIR-HNFVBEJKSA-N
InChI=1S/C17H18N6O/c18-6-4-14(12-2-1-3-15(12)24)23-9-11(8-22-23)16-13-5-7-19-17(13)21-10-20-16/h5,7-10,12,14-15,24H,1-4H2,(H,19,20,21)/t12?,14-,15?/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H18N6O
Molecular Weight 322.3644
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:58:37 GMT 2023
Edited
by admin
on Sat Dec 16 09:58:37 GMT 2023
Record UNII
F9V2A7I5VK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
INCB-27598
Common Name English
RUXOLITINIB METABOLITE M18
Common Name English
1H-PYRAZOLE-1-PROPANENITRILE, .BETA.-(2-HYDROXYCYCLOPENTYL)-4-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)-, (.BETA.R)-
Common Name English
Code System Code Type Description
PUBCHEM
73425533
Created by admin on Sat Dec 16 09:58:38 GMT 2023 , Edited by admin on Sat Dec 16 09:58:38 GMT 2023
PRIMARY
FDA UNII
F9V2A7I5VK
Created by admin on Sat Dec 16 09:58:38 GMT 2023 , Edited by admin on Sat Dec 16 09:58:38 GMT 2023
PRIMARY
CAS
1315607-85-2
Created by admin on Sat Dec 16 09:58:38 GMT 2023 , Edited by admin on Sat Dec 16 09:58:38 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE