Tuberosin
(1R,13R)-7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol
Also Known As: Tuberosin|Tuberosine|(-)-Tuberosin|(+)-Tuberosine|(+)-Tuberosin|TN5192|(1R,13R)-7,7-Dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol|(1R,13R)-7,7-Dimethyl-8,12,20-trioxapentacyclo(11.8.0.02,11.04,9.014,19)henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol|(1R,13R)-7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14,16,18-heptaene-1,17-diol|(6aR)-6a,13abeta-Dihydro-10,10-dimethyl-6H,10H-furo[3,2-c:4,5-g ]bis[1]benzopyran-3,6a-diol|(6aR,13aR)-10,10-Dimethyl-6H,10H-furo[3,2-c:4,5-g ]bis[1]benzopyran-3,6a(13aH)-diol|(6aR,13aR)-10,10-Dimethyl-6H,10H-pyrano[3',2':5,6]benzofuro[3,2-c][1]benzopyran-3,6a(13aH)-diol
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.11542 g/mol |
| LogP | 3.2901 |
| Topological Polar Surface Area | 68.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 338.11542 |
| Monoisotopic Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 929.924 |
Chemical Identifiers
| CAS Number | 41347-45-9 |
|---|---|
| SMILES | CC1(C=CC2=CC3=C(C=C2O1)O[C@H]4[C@@]3(COC5=C4C=CC(=C5)O)O)C |
Product Overview
Tuberosin (CAS 41347-45-9), with molecular formula C20H18O5 and molecular weight 338.11542 g/mol. IUPAC: (1R,13R)-7,7-dimethyl-8,12,20-trioxapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-2(11),3,5,9,14(19),15,17-heptaene-1,17-diol.