N~5~-(Diaminomethylene)-L-Ornithyl-L-Tyrosyl-L-Aspartic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C19H28N6O7
IUPAC Name (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanedioic acid
Molecular Mass 452.462 g·mol−1
Heat of Formation -1250.0 ± 16.7 kJ·mol−1
Dipole Moment 5.37 ± 1.08 D
Volume 543.3 Å 3
Surface Area 435.58 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-1-oxopentyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]butanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]butanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]succinic acid
  • arginyl-tyrosyl-aspartic acid
  • n-(n-l-arginyl-l-tyrosyl)-l-aspartic acid
CAS Number(s)
  • 130022-72-9
InChIKey AOJYORNRFWWEIV-IHRRRGAJSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N