[(2R)-3-methyl-3-oxidanyl-1-(7-oxidanylidenefuro[3,2-g]chromen-4-yl)oxy-butan-2-yl] ethanoate hydrate

Systemtic Name: [(2R)-3-methyl-3-oxidanyl-1-(7-oxidanylidenefuro[3,2-g]chromen-4-yl)oxy-butan-2-yl] ethanoate hydrate Openeye Name: [(1R)-2-hydroxy-2-methyl-1-[(7-oxofuro[3,2-g]chromen-4-yl)oxymethyl]propyl] acetate hydrate CAS Name: acetic acid [(2R)-3-hydroxy-3-methyl-1-[(7-oxo-4-furo[3,2-g][1]benzopyranyl)oxy]butan-2-yl] ester hydrate IUPAC Name: [(2R)-3-hydroxy-3-methyl-1-(7-oxofuro[3,2-g]chromen-4-yl)oxybutan-2-yl] acetate hydrate Traditional Name: acetic acid [(1R)-2-hydroxy-1-[(7-ketofuro[3,2-g]chromen-4-yl)oxymethyl]-2-methyl-propyl] ester hydrate Formula: C18H20O8 MolecularWeight: 364.3466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C(C)(C)O.O

Isomeric SMILES

CC(=O)O[C@H](COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C(C)(C)O.O

InChI

InChI=1S/C18H18O7.H2O/c1-10(19)24-15(18(2,3)21)9-23-17-11-4-5-16(20)25-14(11)8-13-12(17)6-7-22-13;/h4-8,15,21H,9H2,1-3H3;1H2/t15-;/m1./s1