2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one

C20H10O8 — CID 58668709

IUPAC2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one
SMILESO=c1oc2ccc(O)cc2c(O)c1-c1cc2c(=O)oc3ccc(O)cc3c2o1
InChIInChI=1S/C20H10O8/c21-8-1-3-13-10(5-8)17(23)16(20(25)28-13)15-7-12-18(26-15)11-6-9(22)2-4-14(11)27-19(12)24/h1-7,21-23H
InChIKeyZLWAEFPRMSXICF-UHFFFAOYSA-N
MW378.29 g/mol
LogP3.43
Rot. Bonds1

About 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one

2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one (PubChem CID 58668709) has the molecular formula C20H10O8 and a molecular weight of 378.29 g/mol. Its IUPAC name is 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one.

Molecular Properties

Compound Name2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one
PubChem CID58668709
Molecular FormulaC20H10O8
Molecular Weight378.29 g/mol
Exact Mass378.04
IUPAC Name2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one
SMILESO=c1oc2ccc(O)cc2c(O)c1-c1cc2c(=O)oc3ccc(O)cc3c2o1
InChIInChI=1S/C20H10O8/c21-8-1-3-13-10(5-8)17(23)16(20(25)28-13)15-7-12-18(26-15)11-6-9(22)2-4-14(11)27-19(12)24/h1-7,21-23H
InChIKeyZLWAEFPRMSXICF-UHFFFAOYSA-N
XLogP3.43
TPSA134.25 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.29
LogP ≤ 53.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4,6,7-trihydroxy-2-oxochromen-3-yl)furo[3,2-c]chromen-4-one
CID 140850447
2-(4-hydroxy-8-methoxy-2-oxochromen-3-yl)-6-methoxyfuro[3,2-c]chromen-4-one
CID 58668704
6-hydroxy-3-(8-hydroxy-4-oxofuro[3,2-c]chromen-2-yl)chromene-2,4-dione
CID 11222665
4-hydroxy-8,14-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione
CID 143335534
8-hydroxy-3-nitrosobenzo[c]chromen-6-one
CID 144622401
7-hydroxy-3-(4-hydroxyphenyl)-4-methylchromen-2-one
CID 10221024
2,3,7-trihydroxyxanthen-9-one
CID 14528805
2-(3,5-dibromo-4-hydroxyphenyl)-6-hydroxychromen-4-one
CID 54016489
7-hydroxy-3-(4-hydroxy-2-methylphenyl)-4-methylchromen-2-one
CID 89042295
9-(3,8-dihydroxy-6-oxobenzo[c]chromen-9-yl)-3,8-dihydroxybenzo[c]chromen-6-one
CID 11510769
3-amino-4,7-dihydroxychromen-2-one
CID 54691343
4,6-dihydroxy-3-[(E)-3-oxo-1-phenylbut-1-enyl]chromen-2-one
CID 90672193

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one?
The IUPAC name of 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one (CID 58668709) is 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one.
What is the SMILES notation for 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one?
The canonical SMILES for 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one is O=c1oc2ccc(O)cc2c(O)c1-c1cc2c(=O)oc3ccc(O)cc3c2o1.
What is the InChIKey of 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one?
The InChIKey is ZLWAEFPRMSXICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10O8/c21-8-1-3-13-10(5-8)17(23)16(20(25)28-13)15-7-12-18(26-15)11-6-9(22)2-4-14(11)27-19(12)24/h1-7,21-23H.
What are the key properties of 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one?
2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one has a molecular weight of 378.29 g/mol, XLogP of 3.43, 1 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dihydroxy-2-oxochromen-3-yl)-8-hydroxyfuro[3,2-c]chromen-4-one is sourced from PubChem (CID 58668709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).