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Details

Stereochemistry ACHIRAL
Molecular Formula C6H10N2O6
Molecular Weight 206.1534
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-carboxyethyl-nitroamino)propanoic acid

SMILES

OC(=O)CCN(CCC(O)=O)[N+]([O-])=O

InChI

InChIKey=MXPYFZODOSRODU-UHFFFAOYSA-N
InChI=1S/C6H10N2O6/c9-5(10)1-3-7(8(13)14)4-2-6(11)12/h1-4H2,(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula C6H10N2O6
Molecular Weight 206.1534
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 12:18:01 GMT 2023
Edited
by admin
on Sat Dec 16 12:18:01 GMT 2023
Record UNII
9PVE4YHT6P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-carboxyethyl-nitroamino)propanoic acid
Systematic Name English
N-(2-Carboxyethyl)-N-nitro-β-alanine
Systematic Name English
.BETA.-ALANINE, N-(2-CARBOXYETHYL)-N-NITRO-
Systematic Name English
4-Nitro-4-azaheptanedioic acid
Systematic Name English
Propionic acid, 3,3′-(nitroimino)di-
Systematic Name English
3,3'-(nitroazanediyl)dipropanoic acid
Systematic Name English
NSC-206121
Code English
Code System Code Type Description
ECHA (EC/EINECS)
202-779-4
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
CAS
99-69-4
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID9059200
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
PUBCHEM
66839
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
NSC
206121
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
FDA UNII
9PVE4YHT6P
Created by admin on Sat Dec 16 12:18:01 GMT 2023 , Edited by admin on Sat Dec 16 12:18:01 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT