Benzyl N-[(1S)-1-[[(1S)-1-[[(1S,2S)-2-Hydroxy-1-[(4-Hydroxyphenyl)Methyl]-3-Oxo-Propyl]Carbamoyl]-3-Methyl-Butyl]Carbamoyl]-3-Methyl-Butyl]Carbamate

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Properties Simple | Detailed

Formula C30H41N3O7
IUPAC Name benzyl n-[(1s)-1-[[(1s)-1-[[(1s,2s)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]-3-oxo-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamate
Molecular Mass 555.662 g·mol−1
Heat of Formation -1249.7 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 700.15 Å 3
Surface Area 585.94 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -0.25 ± eV
Point Group Symmetry C1
InChIKey PAKIBQXHXYRZNI-YIPNQBBMSA-N
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