α-Amino-6-[[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]amino]-9H-purine-9-propanoic acid

CAS Registry Number®

67392-79-4

CAS Name

α-Amino-6-[[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]amino]-9H-purine-9-propanoic acid

Molecular Formula

C13H18N6O3

Molecular Mass

306.32

Cite this Page

α-Amino-6-[[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]amino]-9H-purine-9-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=67392-79-4 (retrieved 2024-12-28) (CAS RN: 67392-79-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    215-216 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1/C13H18N6O3/c1-8(5-20)2-3-15-11-10-12(17-6-16-11)19(7-18-10)4-9(14)13(21)22/h2,6-7,9,20H,3-5,14H2,1H3,(H,21,22)(H,15,16,17)/b8-2+

InChIKey

InChIKey=LJJHXRRUVASJDX-KRXBUXKQNA-N

SMILES

C(C(C(O)=O)N)N1C=2C(=C(NC/C=C(/CO)\C)N=CN2)N=C1

Canonical SMILES

O=C(O)C(N)CN1C=NC=2C(=NC=NC21)NCC=C(C)CO

Other Names for this Substance

  • 9H-Purine-9-propanoic acid, α-amino-6-[[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]amino]-
  • 9H-Purine-9-propanoic acid, α-amino-6-[(4-hydroxy-3-methyl-2-butenyl)amino]-, (E)-(±)-
  • 9H-Purine-9-propanoic acid, α-amino-6-[(4-hydroxy-3-methyl-2-butenyl)amino]-, (E)-
  • α-Amino-6-[[(2E)-4-hydroxy-3-methyl-2-buten-1-yl]amino]-9H-purine-9-propanoic acid
  • (±)-Lupinic acid

CAS INSIGHTSTM
A collage showcasing diverse technology, including gadgets, devices, and innovative tools in a vibrant arrangement.