(2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone

C104H80O50 — CID 157438816

About (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone

(2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone (PubChem CID 157438816) has the molecular formula C104H80O50 and a molecular weight of 2129.73 g/mol. Its IUPAC name is (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone.

Molecular Properties

• Compound Name: (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone
• PubChem CID: 157438816
• Molecular Formula: C104H80O50
• Molecular Weight: 2129.73 g/mol
• Exact Mass: 2128.37
• IUPAC Name: (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone
• SMILES: O=C(c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1O.O=C(c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O.O=C(c1cc(O)c(O)cc1O)c1ccc(O)c(O)c1O.O=C(c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1.O=C(c1ccc(O)c(O)c1)c1cc(O)c(O)cc1O.O=C(c1ccc(O)cc1)c1cc(O)c(O)c(O)c1.O=C(c1ccc(O)cc1)c1cc(O)c(O)cc1O.O=C(c1ccc(O)cc1O)c1cc(O)c(O)cc1O
• InChI: InChI=1S/C13H10O8.2C13H10O7.3C13H10O6.2C13H10O5/c14-6-1-4(2-7(15)11(6)19)9(17)5-3-8(16)12(20)13(21)10(5)18;14-7-2-1-6(11(18)13(7)20)10(17)5-3-8(15)12(19)9(16)4-5;14-7-2-1-5(12(19)13(7)20)11(18)6-3-9(16)10(17)4-8(6)15;14-8-2-1-6(3-10(8)16)13(19)7-4-11(17)12(18)5-9(7)15;14-8-2-1-6(3-9(8)15)12(18)7-4-10(16)13(19)11(17)5-7;14-6-1-2-7(9(15)3-6)13(19)8-4-11(17)12(18)5-10(8)16;14-9-3-1-7(2-4-9)12(17)8-5-10(15)13(18)11(16)6-8;14-8-3-1-7(2-4-8)13(18)9-5-11(16)12(17)6-10(9)15/h1-3,14-16,18-21H;1-4,14-16,18-20H;1-4,14-17,19-20H;1-5,14-18H;1-5,14-17,19H;1-5,14-18H;1-6,14-16,18H;1-6,14-17H
• InChIKey: BRKQIXXROXJDTO-UHFFFAOYSA-N
• XLogP: 10.98
• TPSA: 986.22 Ų
• H-Bond Donors: 42
• H-Bond Acceptors: 50
• Rotatable Bonds: 16
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2129.73
LogP ≤ 5	10.98
H-Bond Donors ≤ 5	42
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone?

The IUPAC name of (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone (CID 157438816) is (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone.

What is the SMILES notation for (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone?

The canonical SMILES for (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone is O=C(c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1O.O=C(c1cc(O)c(O)c(O)c1)c1ccc(O)c(O)c1O.O=C(c1cc(O)c(O)cc1O)c1ccc(O)c(O)c1O.O=C(c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1.O=C(c1ccc(O)c(O)c1)c1cc(O)c(O)cc1O.O=C(c1ccc(O)cc1)c1cc(O)c(O)c(O)c1.O=C(c1ccc(O)cc1)c1cc(O)c(O)cc1O.O=C(c1ccc(O)cc1O)c1cc(O)c(O)cc1O.

What is the InChIKey of (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone?

The InChIKey is BRKQIXXROXJDTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O8.2C13H10O7.3C13H10O6.2C13H10O5/c14-6-1-4(2-7(15)11(6)19)9(17)5-3-8(16)12(20)13(21)10(5)18;14-7-2-1-6(11(18)13(7)20)10(17)5-3-8(15)12(19)9(16)4-5;14-7-2-1-5(12(19)13(7)20)11(18)6-3-9(16)10(17)4-8(6)15;14-8-2-1-6(3-10(8)16)13(19)7-4-11(17)12(18)5-9(7)15;14-8-2-1-6(3-9(8)15)12(18)7-4-10(16)13(19)11(17)5-7;14-6-1-2-7(9(15)3-6)13(19)8-4-11(17)12(18)5-10(8)16;14-9-3-1-7(2-4-9)12(17)8-5-10(15)13(18)11(16)6-8;14-8-3-1-7(2-4-8)13(18)9-5-11(16)12(17)6-10(9)15/h1-3,14-16,18-21H;1-4,14-16,18-20H;1-4,14-17,19-20H;1-5,14-18H;1-5,14-17,19H;1-5,14-18H;1-6,14-16,18H;1-6,14-17H.

What are the key properties of (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone?

(2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone has a molecular weight of 2129.73 g/mol, XLogP of 10.98, 16 rotatable bonds, 42 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for (2,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(3,4-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(4-hydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4,5-tetrahydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(2,4,5-trihydroxyphenyl)methanone;(2,3,4-trihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone is sourced from PubChem (CID 157438816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).