5'-S-(3-{[(3R)-1,2,3,4-Tetrahydro-3-Isoquinolinylcarbonyl]Amino}Propyl)-5'-Thioadenosine
Properties
Property | Value |
---|---|
Formula | C23H29N7O4S |
IUPAC Name | (3r)-n-[3-[[(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylsulfanyl]propyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Molecular Mass | 499.586 g·mol−1 |
Heat of Formation | -436.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.80 ± 1.08 D |
Volume | 579.77 Å 3 |
Surface Area | 413.13 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | 2.16 ± eV |
Point Group Symmetry | C1 |
InChIKey | HMZSUDMWDJASBZ-AXKRAVOISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |