Molecule ID: 4598884

IUPAC Name: 4-(7-hydroxy-19-oxo-2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(22),3(12),4(9),5,7,10,13,15,17,20-decaen-13-yl)benzene-1,3-dicarboxylic acid

Description: The molecule is a carboxynaphthofluorescein compound having a carboxy substituent at the 5-position. It has a role as a fluorochrome. It derives from a fluorescein.

SMILES: O=C(O)c1ccc(-c2c3ccc4cc(O)ccc4c3oc3c2ccc2cc(=O)ccc23)c(C(=O)O)c1

SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][C][C][=C][C][=C][C][=C][Branch1][C][O][C][=C][C][Ring1][#Branch1][=C][Ring1][O][O][C][C][=Ring1][#C][C][=C][C][=C][C][=Branch1][C][=O][C][=C][C][Ring1][#Branch1][=Ring1][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring1][P]

InChI: InChI=1S/C29H16O7/c30-17-4-9-19-14(11-17)1-7-22-25(21-6-3-16(28(32)33)13-24(21)29(34)35)23-8-2-15-12-18(31)5-10-20(15)27(23)36-26(19)22/h1-13,30H,(H,32,33)(H,34,35)

Molecular Properties:
- Polar Surface Area: 121.0 Ų
- LogP: 3.6