4-(3-methylbut-2-enyl)-1,3,6-tris(oxidanyl)xanthen-9-one

Systemtic Name: 4-(3-methylbut-2-enyl)-1,3,6-tris(oxidanyl)xanthen-9-one Openeye Name: 1,3,6-trihydroxy-4-(3-methylbut-2-enyl)xanthen-9-one CAS Name: 1,3,6-trihydroxy-4-(3-methylbut-2-enyl)-9-xanthenone IUPAC Name: 1,3,6-trihydroxy-4-(3-methylbut-2-enyl)xanthen-9-one Traditional Name: 1,3,6-trihydroxy-4-(3-methylbut-2-enyl)xanthone Formula: C18H16O5 MolecularWeight: 312.31664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C2=C1OC3=C(C2=O)C=CC(=C3)O)O)O)C

Isomeric SMILES

CC(=CCC1=C(C=C(C2=C1OC3=C(C2=O)C=CC(=C3)O)O)O)C

InChI

InChI=1S/C18H16O5/c1-9(2)3-5-11-13(20)8-14(21)16-17(22)12-6-4-10(19)7-15(12)23-18(11)16/h3-4,6-8,19-21H,5H2,1-2H3