U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H25N6O5P
Molecular Weight 400.37
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-((((R)-1-(6-AMINO-9H-PURIN-9-YL)PROPAN-2-YL)OXY)METHYL)-N-((S)-1-ISOPROPOXY-1-OXOPROPAN-2-YL)PHOSPHONAMIDIC ACID

SMILES

CC(C)OC(=O)[C@H](C)NP(O)(=O)CO[C@H](C)CN1C=NC2=C(N)N=CN=C12

InChI

InChIKey=BOVSGPQGGHVIEX-MNOVXSKESA-N
InChI=1S/C15H25N6O5P/c1-9(2)26-15(22)11(4)20-27(23,24)8-25-10(3)5-21-7-19-12-13(16)17-6-18-14(12)21/h6-7,9-11H,5,8H2,1-4H3,(H2,16,17,18)(H2,20,23,24)/t10-,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H25N6O5P
Molecular Weight 400.37
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 18:59:49 GMT 2023
Edited
by admin
on Sat Dec 16 18:59:49 GMT 2023
Record UNII
X6N6W25UXQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-((((R)-1-(6-AMINO-9H-PURIN-9-YL)PROPAN-2-YL)OXY)METHYL)-N-((S)-1-ISOPROPOXY-1-OXOPROPAN-2-YL)PHOSPHONAMIDIC ACID
Systematic Name English
N-((((1R)-2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY)METHYL)HYDROXYPHOSPHINYL)-L-ALANINE 1-METHYLETHYL ESTER
Common Name English
L-ALANINE, N-((((1R)-2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY)METHYL)HYDROXYPHOSPHINYL)-, 1-METHYLETHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
X6N6W25UXQ
Created by admin on Sat Dec 16 18:59:49 GMT 2023 , Edited by admin on Sat Dec 16 18:59:49 GMT 2023
PRIMARY
CAS
851456-00-3
Created by admin on Sat Dec 16 18:59:49 GMT 2023 , Edited by admin on Sat Dec 16 18:59:49 GMT 2023
PRIMARY
PUBCHEM
118989103
Created by admin on Sat Dec 16 18:59:49 GMT 2023 , Edited by admin on Sat Dec 16 18:59:49 GMT 2023
PRIMARY