Compound: STICTIC ACID
SMILES: O=C1Oc2c(c3c(C(=O)OC3O)c(c2C)O)Oc4c1c(cc(c4C=O)OC)C
InChIKey: SKCUFZLDTAYNBZ-UHFFFAOYSA-N
Synonyms: STICTIC ACID, 549-06-4, NSC-87511, NZR6AX77LP, 1,3-Dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 13,17-Dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde, DTXSID20972053, 1,3-Dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde, 7H-Isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo(9.7.0.03,8.014,18)octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde, RefChem:185743, DTXCID901399540, 633-383-3, NSC87511, CHEMBL173530, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-E]indene-11-carbaldehyde, SCOPULARIC ACID, C19H14O9, NSC 87511, STICTICACID, Spectrum_000600, Spectrum2_000307, Spectrum3_001185, Spectrum4_001446, Spectrum5_000031, UNII-NZR6AX77LP, Stictic acid (StA), 1, BSPBio_002829, KBioGR_001931, KBioSS_001080, SPECTRUM300006, 56614-93-8, cid_73677, MLS001049107, REGID_for_CID_73677, SPBio_000274, orb1694413, SCHEMBL13495711, SCHEMBL29394416, CHEBI:93839, KBio2_001080, KBio2_003648, KBio2_006216, KBio3_002329, SKCUFZLDTAYNBZ-UHFFFAOYSA-N, GLXC-22180, HMS2271H11, BDBM50056922, CCG-38584, MFCD00053529, STL564823, AKOS027326813, EBC-617122, SDCCGMLS-0066543.P001, NCGC00095566-01, NCGC00095566-02, NCGC00095566-03, NCGC00095566-04, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde,1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, DA-78049, FS138501, NCI60_041935, SMR000386939, TS-08833, HY-126779, CS-0107316, NS00134218, dihydroxy-methoxy-dimethyl-dioxo-[?]carbaldehyde, SR-01000758942, Q3604558, SR-01000758942-2, BRD-A29578214-001-02-7, BRD-A29578214-001-08-4, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-E]indene-11-carbaldehyde #, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-benzo[e]furo[3'',4'':3,4]benzo[b][1,4]dioxepine-11-carbaldehyde, 1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-3,7-dihydro-1H-benzo[6,7][1,4]dioxepino[2,3-e]isobenzofuran-11-carbaldehyde, 13,17-dihydroxy-5-methoxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.0^{3,8}.0^{14,18}]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde, Isophthalaldehydic acid,.alpha.2,4,6-tetrahydroxy-2,5-xylyl)oxy]-4-methoxy-6-methyl-, .gamma.-lactone, .epsilon.-lactone
Theoretical properties:
molecular_formula: C19H14O9
molecular_weight: 386.3 g/mol
exact_mass: 386.06378202 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 9
rotatable_bond_count: 2
heavy_atom_count: 28
topological_polar_surface_area: 129 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: LSM-4387 is an aromatic ether.
chembl: STICTIC ACID is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Stictic acid is an aromatic organic compound, a product of secondary metabolism in some species of lichens.
Stictic acid is the subject of preliminary biomedical research. Stictic acid has cytotoxic and apoptotic effects in vitro. Computational studies suggest stictic acid may also stimulate  reactivation of mutant p53.