Dothistromin
(4R,6R,8S)-2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione
Also Known As: Dothistromin|Dothistromin (1)|KST-1A3835|(2r,3ar,12as)-2,3a,4,6,9-pentahydroxy-2,3,3a,12a-tetrahydroanthra[2,3-b]furo[3,2-d]furan-5,10-dione|Anthra(2,3-b)furo(3,2-d)furan-5,10-dione, 2,3,3a,12a-tetrahydro-2,3a,4,6,9-pentahydroxy-, (2R,3aR,12aS)-|(4R,6R,8S)-2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione|Anthra(2,3-b)furo(3,2-d)furan-5,10-dione, 2,3,3a,12a-tetrahydro-2,3a,4,6,9-pentahydroxy-, stereoisomer|2,3a,4,6,9-Pentahydroxy-2,3,3a,12a-tetrahydroanthra[2,3-b]furo[3,2-d]furan-5,10-dione|(2R)-2,3,3aalpha,12aalpha-Tetrahydro-2beta,3a,4,6,9-pentahydroxyanthra[2,3-b]furo[3,2-d]furan-5,10-dione|(2R,3aR,12aS)-2,3,3a,12a-Tetrahydro-2,3a,4,6,9-pentahydroxyanthra(2,3-b)furo(3,2-d)furan-5,10-dione|(4R,6R,8S)-2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo(10.8.0.03,10.04,8.014,19)icosa-1,3(10),11,14,16,18-hexaene-13,20-dione|(4R,6R,8S)-2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1(12),2,10,14,16,18-hexaene-13,20-dione|ANTHRA(2,3-B)FURO(3,2-D)FURAN-5,10-DIONE, 2,3,3A,12A-TETRAHYDRO-2,3A,4,6,9-PENTAHYDROXY-, (2R-(2.ALPHA.,3A.BETA.,12A.BETA.))-|Anthra[2,3-b]furo[3,2-d]furan-5,10-dione, 2,3,3a,12a-tetrahydro-2,3a,4,6,9-pentahydroxy-, [2R-(2.alpha.,3a.beta.,12a.beta.)]-|Anthra[2,3-b]furo[3,2-d]furan-5,10-dione, 2,3,3a,12a-tetrahydro-2,3a,4,6,9-pentahydroxy-, stereoisomer
| Molecular Formula | C18H12O9 |
|---|---|
| Molecular Weight | 372.04813 g/mol |
| LogP | 0.22 |
| Topological Polar Surface Area | 153.75 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 372.04813 |
| Heavy Atoms | 27 |
| Complexity | 1073.2 |
Chemical Identifiers
| CAS Number | 31456-72-1 |
|---|---|
| SMILES | C1[C@@H](O[C@H]2[C@@]1(C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C=CC(=C5C4=O)O)O)O)O |
Product Overview
Dothistromin (CAS 31456-72-1), with molecular formula C18H12O9 and molecular weight 372.04813 g/mol. IUPAC: (4R,6R,8S)-2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione.
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