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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H25N3O9
Molecular Weight 403.3844
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-9404C

SMILES

CC(C)NC[C@H](O)COC1=CC=C(COC[C@@H](CO[N+]([O-])=O)O[N+]([O-])=O)C=C1

InChI

InChIKey=FIAGQHFOTZHMQM-HOCLYGCPSA-N
InChI=1S/C16H25N3O9/c1-12(2)17-7-14(20)9-26-15-5-3-13(4-6-15)8-25-10-16(28-19(23)24)11-27-18(21)22/h3-6,12,14,16-17,20H,7-11H2,1-2H3/t14-,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H25N3O9
Molecular Weight 403.3844
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:12:09 GMT 2023
Edited
by admin
on Sat Dec 16 08:12:09 GMT 2023
Record UNII
5U7448TI2Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-9404C
Common Name English
1,2-PROPANEDIOL, 3-((4-((2S)-2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)PHENYL)METHOXY)-, 1,2-DINITRATE, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
10476270
Created by admin on Sat Dec 16 08:12:09 GMT 2023 , Edited by admin on Sat Dec 16 08:12:09 GMT 2023
PRIMARY
FDA UNII
5U7448TI2Z
Created by admin on Sat Dec 16 08:12:09 GMT 2023 , Edited by admin on Sat Dec 16 08:12:09 GMT 2023
PRIMARY
CAS
780825-97-0
Created by admin on Sat Dec 16 08:12:09 GMT 2023 , Edited by admin on Sat Dec 16 08:12:09 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY