[2-Amino-3-[3-[2-[2-[3-[[2-[3-[4-[3-[[3-Nitro-5-[(2R,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Benzoyl]Amino]Propyl]Piperazin-1-Yl]Propylamino]-3,4-Dioxo-Cyclobutyl]Amino]Propoxy]Ethoxy]Ethoxy]Propylcarbamoyloxy]Propyl] N-[3-[2-[2-[3-[[(1S)-2-[3-[4-[3-[[3-Nitro-5-[(2R,3R,4R,5S,6S)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Benzoyl]Amino]Propyl]Piperazin-1-Yl]Propylamino]-3,4-Dioxo-Cyclobutyl]Amino]Propoxy]Ethoxy]Ethoxy]Propyl]Carbamate
Properties
Property | Value |
---|---|
Formula | C79H127N15O32 |
IUPAC Name | [2-amino-3-[3-[2-[2-[3-[[2-[3-[4-[3-[[3-nitro-5-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzoyl]amino]propyl]piperazin-1-yl]propylamino]-3,4-dioxo-cyclobutyl]amino]propoxy]ethoxy]ethoxy]propylcarbamoyloxy]propyl] n-[3-[2-[2-[3-[[(1s)-2-[3-[4-[3-[[3-nitro-5-[(2r,3r,4r,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzoyl]amino]propyl]piperazin-1-yl]propylamino]-3,4-dioxo-cyclobutyl]amino]propoxy]ethoxy]ethoxy]propyl]carbamate |
Molecular Mass | 1798.935 g·mol−1 |
Heat of Formation | -4316.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 18.90 ± 1.08 D |
Volume | 2175.64 Å 3 |
Surface Area | 1708.14 Å 2 |
HOMO Energy | -7.82 ± 0.55 eV |
LUMO Energy | -1.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | MCYGUUGTPDZMBU-PITJZOSMSA-N |
QR Code | Generate QR Code |
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Elements | H C O N |