1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)

CAS Registry Number®

6986-91-0

CAS Name

1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)

Molecular Formula

C6H8O7.3C4H11NO3

Cite this Page

1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6986-91-0 (retrieved 2024-11-22) (CAS RN: 6986-91-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H8O7.C4H11NO3/c7-3(8)1-6(13,5(11)12)2-4(9)10;5-4(1-6,2-7)3-8/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);6-8H,1-3,5H2

InChIKey

InChIKey=VTMHBUDWQBDMQS-UHFFFAOYSA-N

SMILES

C(CC(O)=O)(CC(O)=O)(C(O)=O)O.C(CO)(CO)(CO)N

Canonical SMILES

O=C(O)CC(O)(C(=O)O)CC(=O)O.OCC(N)(CO)CO

Other Names for this Substance

  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, citrate (3:1) (salt)
  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) (salt)

CAS INSIGHTSTM
Targeted protein degrader structure, illustration