Diosbulbin B
Properties
- Molecular formula
- C19H20O6
- Molar mass
- 344.36 g/mol
- Exact mass
- 344.1260 Da
- Melting point
- 285 °C
- logP
- 2.38Crippen estimate
- Polar surface area
- 75.0 Ų
- H-bond donors / acceptors
- 0 / 6
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
20086-06-0SMILES
CC12CC(c3ccoc3)OC13CC(OC3=O)C1C3CC(CC12)OC3=OInChIKey
QEANLIISUSNNDX-UHFFFAOYSA-NInChI
InChI=1S/C19H20O6/c1-18-6-13(9-2-3-22-8-9)25-19(18)7-14(24-17(19)21)15-11-4-10(5-12(15)18)23-16(11)20/h2-3,8,10-15H,4-7H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- 4H-3a,6:7,10-Dimethanofuro[2,3-c]oxepino[4,5-e]oxepin-4,8(6H)-dione, 2-(3-furanyl)octahydro-11b-methyl-, (2R,3aS,6S,6aS,7R,10R,11aR,11bS)-
- 4H-3a,6:7,10-Dimethanofuro[2,3-c]oxepino[4,5-e]oxepin-4,8(6H)-dione, 2-(3-furanyl)octahydro-11b-methyl-, [2R-(2α,3aβ,6β,6aβ,7β,10β,11aα,11bβ)]-
- (2R,3aS,6S,6aS,7R,10R,11aR,11bS)-2-(3-Furanyl)octahydro-11b-methyl-4H-3a,6:7,10-dimethanofuro[2,3-c]oxepino[4,5-e]oxepin-4,8(6H)-dione
Work with Diosbulbin B
Similar compounds
Tanimoto similarity of circular fingerprints over the whole catalogue.