(3S,4S)-3,6-Diamino-N-[(3S,6Z,9S,12S,15S)-3-[(4R)-2-Amino-1,4,5,6-Tetrahydro-4-Pyrimidinyl]-6-[(Carbamoylamino)Methylene]-9,12-Bis(Hydroxymethyl)-2,5,8,11,14-Pentaoxo-1,4,7,10,13-Pentaazacyclohexadecan-15-Yl]-4-Hydroxyhexanamide
Properties
| Property | Value |
|---|---|
| Formula | C25H43N13O10 |
| IUPAC Name | (3r,4r)-3,6-diamino-n-[(3r,6z,9s,12s,15s)-3-[(6r)-2-amino-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-6-(ureidomethylene)-1,4,7,10,13-pentazacyclohexadec-15-yl]-4-hydroxy-hexanamide |
| Molecular Mass | 685.690 g·mol−1 |
| Heat of Formation | -1703.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.31 ± 1.08 D |
| Volume | 795.43 Å 3 |
| Surface Area | 608.13 Å 2 |
| HOMO Energy | -8.64 ± 0.55 eV |
| LUMO Energy | -0.40 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HPWIIERXAFODPP-IKQCJOCBSA-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 |