Methyl N-[(2S,3R)-3-Amino-2-Hydroxyheptanoyl]-L-Seryl-L-Leucinate

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Properties Simple | Detailed

Formula C17H33N3O6
IUPAC Name methyl (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-heptanoyl]amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoate
Molecular Mass 375.460 g·mol−1
Heat of Formation -1299.1 ± 16.7 kJ·mol−1
Dipole Moment 5.07 ± 1.08 D
Volume 481.98 Å 3
Surface Area 421.27 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 3.58 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-1-oxoheptyl]amino]-3-hydroxy-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-heptanoyl]amino]-3-hydroxy-propanoyl]amino]-4-methyl-valeric acid methyl ester
  • 2-[2-(3-amino-2-hydroxy-heptanoylamino)-3-hydroxy-propionylamino]-4-methyl-pentanoic acid methyl ester
  • methyl (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-heptanoyl]amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoate
  • methyl (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxyheptanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoate
InChIKey ZERLQNOHSLWIIV-RFGFWPKPSA-N
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