(10R,11S,12S,14R,16S,20S,21R,22S,24E)-16-[(R)-Amino(Hydroxy)Methoxy]-12-Hydroxy-20-{(2S,3S,7R,8R,9R,10E)-11-[(Hydroxymethyl)(Methyl)Amino]-2,8-Dimethoxy-3,7,9-Trimethyl-6-Oxo-10-Undecen-1-Yl}-10,22-Dimethoxy-11,14,21-Trimethyl-3,7,19,27-Tetraoxa-29,30,31-Triazatetracyclo[24.2.1.1~2,5~.1~6,9~]Hentriaconta-1(28),2(31),4,6(30),8,24,26(29)-Heptaen-18-One
Properties
Property | Value |
---|---|
Formula | C48H75N5O14 |
IUPAC Name | (10r,11s,12s,14r,16s,20s,21r,22s,24e)-16-[(r)-amino(hydroxy)methoxy]-12-hydroxy-20-{(2s,3s,7r,8r,9r,10e)-11-[(hydroxymethyl)(methyl)amino]-2,8-dimethoxy-3,7,9-trimethyl-6-oxo-10-undecen-1-yl}-10,22-dimethoxy-11,14,21-trimethyl-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.1 2,5 .1 6,9 ]hentriaconta-1(28),2(31),4,6(30),8,24,26(29)-heptaen-18-one |
Molecular Mass | 946.134 g·mol−1 |
Heat of Formation | -2262.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.90 ± 1.08 D |
Volume | 1190.48 Å 3 |
Surface Area | 837.88 Å 2 |
HOMO Energy | -8.57 ± 0.55 eV |
LUMO Energy | -0.78 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | XYKNXOJYKRVXBX-ZAUPHERQSA-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 |