2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

C75H62O26 — CID 163065834

About 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol (PubChem CID 163065834) has the molecular formula C75H62O26 and a molecular weight of 1379.29 g/mol. Its IUPAC name is 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol.

Molecular Properties

• Compound Name: 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
• PubChem CID: 163065834
• Molecular Formula: C75H62O26
• Molecular Weight: 1379.29 g/mol
• Exact Mass: 1378.35
• IUPAC Name: 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
• SMILES: Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2
• InChI: InChI=1S/C75H62O26/c76-33-25-51(91)57-53(26-33)97-69(29-2-11-38(78)47(87)20-29)66(96)62(57)61-45(85)18-9-36-56(65(95)72(101-75(36)61)32-5-14-41(81)50(90)23-32)60-44(84)17-8-35-55(64(94)71(100-74(35)60)31-4-13-40(80)49(89)22-31)59-43(83)16-7-34-54(63(93)70(99-73(34)59)30-3-12-39(79)48(88)21-30)58-42(82)15-6-28-24-52(92)67(98-68(28)58)27-1-10-37(77)46(86)19-27/h1-23,25-26,52,54-56,62-67,69-72,76-96H,24H2
• InChIKey: FRMOPMVHIOQPAZ-UHFFFAOYSA-N
• XLogP: 8.52
• TPSA: 470.98 Ų
• H-Bond Donors: 21
• H-Bond Acceptors: 26
• Rotatable Bonds: 9
• Heavy Atoms: 101
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1379.29
LogP ≤ 5	8.52
H-Bond Donors ≤ 5	21
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol?

The IUPAC name of 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol (CID 163065834) is 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol.

What is the SMILES notation for 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol?

The canonical SMILES for 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol is Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2c1c(O)ccc2c1OC(c1ccc(O)c(O)c1)C(O)C2.

What is the InChIKey of 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol?

The InChIKey is FRMOPMVHIOQPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H62O26/c76-33-25-51(91)57-53(26-33)97-69(29-2-11-38(78)47(87)20-29)66(96)62(57)61-45(85)18-9-36-56(65(95)72(101-75(36)61)32-5-14-41(81)50(90)23-32)60-44(84)17-8-35-55(64(94)71(100-74(35)60)31-4-13-40(80)49(89)22-31)59-43(83)16-7-34-54(63(93)70(99-73(34)59)30-3-12-39(79)48(88)21-30)58-42(82)15-6-28-24-52(92)67(98-68(28)58)27-1-10-37(77)46(86)19-27/h1-23,25-26,52,54-56,62-67,69-72,76-96H,24H2.

What are the key properties of 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol?

2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol has a molecular weight of 1379.29 g/mol, XLogP of 8.52, 9 rotatable bonds, 21 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-4-[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,7-dihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromene-3,5,7-triol is sourced from PubChem (CID 163065834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).