1-[3-(3-{[(1S,2R)-1-Carboxy-2-Hydroxypropyl]Carbamoyl}-6-Hydroxy-9H-β-Carbolin-1-Yl)Propanoyl]-L-Proline

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Properties Simple | Detailed

Formula C24H26N4O8
IUPAC Name (2s)-1-[3-[3-[[(1s,2r)-1-carboxy-2-hydroxy-propyl]carbamoyl]-6-hydroxy-9h-pyrido[3,4-b]indol-1-yl]propanoyl]pyrrolidine-2-carboxylic acid
Molecular Mass 498.485 g·mol−1
Heat of Formation -1324.6 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 569.29 Å 3
Surface Area 429.69 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
InChIKey HYBYPROKTWYUIQ-PEECDGGASA-N
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