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Heterocyclic compounds

Dibalanocarpol

Also known as bis(4-hydroxyphenyl)-[tetrahydroxy-bis(4-hydroxyphenyl)[?]yl][?]tetrol

CAS 204644-73-5Formula C56H42O14Molar mass 938.94 g/mol
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Dibalanocarpol chemical structure, C56H42O14, CAS 204644-73-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
204644-73-5
Formula
C56H42O14
Molar mass
938.94 g/mol
HS code
293299
Category
Heterocyclic compounds

What is Dibalanocarpol?

Plain description, key identifiers and synonyms

Dibalanocarpol is a chemical substance with the molecular formula C56H42O14 and a molar mass of 938.94 g/mol. Its CAS registry number is 204644-73-5. The IUPAC name is (1R,8S,9S,16R)-8,16-bis(4-hydroxyphenyl)-9-[(1R,8S,9S,16R)-4,6,9,12-tetrahydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaen-9-yl]-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaene-4,6,9,12-tetrol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,8S,9S,16R)-8,16-bis(4-hydroxyphenyl)-9-[(1R,8S,9S,16R)-4,6,9,12-tetrahydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaen-9-yl]-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaene-4,6,9,12-tetrol
CAS number
204644-73-5
Molecular formula
C56H42O14
InChIKey
AETOAAQSGCSQKP-PWJWKHQFSA-N
InChI
InChI=1S/C56H42O14/c57-29-9-1-25(2-10-29)51-45-37(17-33(61)21-41(45)65)47-49-39(19-35(63)23-43(49)69-53(47)27-5-13-31(59)14-6-27)55(51,67)56(68)40-20-36(64)24-44-50(40)48(54(70-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)46(38)52(56)26-3-11-30(58)12-4-26/h1-24,47-48,51-54,57-68H/t47-,48-,51+,52+,53+,54+,55-,56-/m1/s1
SMILES
C1=CC(=CC=C1[C@H]2[C@@H]3C4=C([C@@H]([C@](C5=C3C(=CC(=C5)O)O2)([C@@]6([C@H](C7=C(C=C(C=C7O)O)[C@H]8[C@@H](OC9=CC(=CC6=C89)O)C1=CC=C(C=C1)O)C1=CC=C(C=C1)O)O)O)C1=CC=C(C=C1)O)C(=CC(=C4)O)O)O

Synonyms

  • bis(4-hydroxyphenyl)-[tetrahydroxy-bis(4-hydroxyphenyl)[?]yl][?]tetrol

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
938.94 g/molcalc.
Exact mass
938.2575 Dacalc.
LogP (octanol/water)
8.64calc.
Topological polar surface area
261.2 Ųcalc.
Hydrogen bond donors
12calc.
Hydrogen bond acceptors
14calc.
Rotatable bonds
5calc.
Heavy atoms
70calc.
Rings
12calc.
Aromatic rings
8calc.
Fraction sp3 carbons
0.14calc.
Formal charge
0calc.
Stereocentres
8calc.
Lipinski rule of five
Fails (4 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc(C2Oc3cccc4c3C2c2ccccc2C(c2ccccc2)C4C2c3cccc4c3C(c3ccccc3C2c2ccccc2)C(c2ccccc2)O4)cc1

c1ccc(C2Oc3cccc4c3C2c2ccccc2C(c2ccccc2)C4C2c3cccc4c3C(c3ccccc3C2c2ccccc2)C(c2ccccc2)O4)cc1

12 rings, 58 atoms.

6 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Dibalanocarpol suppliers

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Dibalanocarpol price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Dibalanocarpol is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Dibalanocarpol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Dibalanocarpol, based on the data on this page

What is Dibalanocarpol?

Dibalanocarpol is a chemical substance with the molecular formula C56H42O14 and a molar mass of 938.94 g/mol. Its CAS registry number is 204644-73-5.

What is the CAS number of Dibalanocarpol?

The CAS registry number of Dibalanocarpol is 204644-73-5.

What is the molecular formula and weight of Dibalanocarpol?

The molecular formula of Dibalanocarpol is C56H42O14 and its molar mass is 938.94 g/mol.

Is Dibalanocarpol hazardous?

No GHS hazard classification for Dibalanocarpol is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Dibalanocarpol?

Dibalanocarpol is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Dibalanocarpol?

Post a free request on CompoundList and suppliers of Dibalanocarpol will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Dibalanocarpol?

Suppliers quote Dibalanocarpol on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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