Gilvocarcin E
4-[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(1R)-1-hydroxyethyl]oxolan-2-yl]-8-ethyl-1-hydroxy-10,12-dimethoxynaphtho[1,2-c]isochromen-6-one
Also Known As: Gilvocarcin E|dihydrotoromycin|HY-N14522|4-Fucofuranosyl-1-hydroxy-10,12-dimethoxy-8-ethyl-6H-benzo(d)naphtho(1,2b)pyran-6-one|4-[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(1R)-1-hydroxyethyl]oxolan-2-yl]-8-ethyl-1-hydroxy-10,12-dimethoxynaphtho[1,2-c]isochromen-6-one|(1r)-1,4-Anhydro-6-Deoxy-1-[(6r)-8-Ethenyl-1,6-Dihydroxy-10,12-Dimethoxy-6h-Dibenzo[c,H]chromen-4-Yl]-D-Galactitol|4-((2R,3R,4R)-3,4-dihydroxy-5-((1R)-1-hydroxyethyl)oxolan-2-yl)-8-ethyl-1-hydroxy-10,12-dimethoxynaphtho(1,2-c)isochromen-6-one|6H-Benzo(d)naphtho(1,2-b)pyran-6-one, 4-(6-deoxy-alpha-galactofuranosyl)-8-ethyl-1-hydroxy-10,12-dimethoxy-|8-Ethyl-4-(6-deoxy-alpha-L-galactofuranosyl)-1-hydroxy-10,12-dimethoxy-6H-benzo[d]naphtho[1,2-b]pyran-6-one|VGP
| Molecular Formula | C27H28O9 |
|---|---|
| Molecular Weight | 496.17334 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.17334 |
| Monoisotopic Mass | 496.17334 |
| Heavy Atoms | 36 |
| Complexity | 793.0 |
Chemical Identifiers
| CAS Number | 80937-34-4 |
|---|---|
| SMILES | CCC1=CC2=C(C(=C1)OC)C3=C(C4=C(C=CC(=C4C(=C3)OC)O)[C@@H]5[C@@H]([C@H]([C@@H](O5)[C@@H](C)O)O)O)OC2=O |
| InChIKey | MHEQKYHSXMKYKF-UCDARZNSSA-N |
Product Overview
Gilvocarcin E (CAS 80937-34-4), with molecular formula C27H28O9 and molecular weight 496.17334 g/mol. IUPAC: 4-[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(1R)-1-hydroxyethyl]oxolan-2-yl]-8-ethyl-1-hydroxy-10,12-dimethoxynaphtho[1,2-c]isochromen-6-one.