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Screening compounds

Pholcodine citrate

Also known as Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-17-methyl-3-(2-(4-morpholinyl)ethoxy)-, (5alpha,6alpha)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt), DEA NO. 9314 (Citrate), Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-17-methyl-3-(2-(4-morpholinyl)ethoxy)-, (5alpha,6.alpha.)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)

CAS 14053-60-2Formula C29H38N2O11Molar mass 590.63 g/mol
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Pholcodine citrate chemical structure, C29H38N2O11, CAS 14053-60-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
14053-60-2
Formula
C29H38N2O11
Molar mass
590.63 g/mol
HS code
293499
Category
Screening compounds

What is Pholcodine citrate?

Plain description, key identifiers and synonyms

Pholcodine citrate is a chemical substance with the molecular formula C29H38N2O11 and a molar mass of 590.63 g/mol. Its CAS registry number is 14053-60-2. The IUPAC name is (4R,4aR,7S,7aR,12bS)-3-methyl-9-(2-morpholin-4-ylethoxy)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol, 2-hydroxypropane-1,2,3-tricarboxylic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4R,4aR,7S,7aR,12bS)-3-methyl-9-(2-morpholin-4-ylethoxy)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol, 2-hydroxypropane-1,2,3-tricarboxylic acid
CAS number
14053-60-2
Molecular formula
C29H38N2O11
UNII
K7Z9OPE11S
InChIKey
YQRMJBKLKRYXSC-RNFKYSJUSA-N
InChI
InChI=1S/C23H30N2O4.C6H8O7/c1-24-7-6-23-16-3-4-18(26)22(23)29-21-19(5-2-15(20(21)23)14-17(16)24)28-13-10-25-8-11-27-12-9-25;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-5,16-18,22,26H,6-14H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t16-,17+,18-,22-,23-;/m0./s1
Canonical SMILES
CN1CCC23c4c5ccc(OCCN6CCOCC6)c4OC2C(O)C=CC3C1C5.O=C(O)CC(O)(CC(=O)O)C(=O)O
Isomeric SMILES
CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OCCN6CCOCC6)O[C@H]3[C@H](C=C4)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Synonyms

  • Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-17-methyl-3-(2-(4-morpholinyl)ethoxy)-, (5alpha,6alpha)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)
  • DEA NO. 9314 (Citrate)
  • Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-17-methyl-3-(2-(4-morpholinyl)ethoxy)-, (5alpha,6.alpha.)-, 2-hydroxy-1,2,3-propanetricarboxylate (salt)

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
590.63 g/molcalc.
Exact mass
590.2476 Dacalc.
LogP (octanol/water)
-0.04calc.
Topological polar surface area
186.5 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
10calc.
Rotatable bonds
9calc.
Heavy atoms
42calc.
Rings
6calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.62calc.
Formal charge
0calc.
Stereocentres
5calc.
Components
2calc.
Lipinski rule of five
Passes (1 violation)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, C1=CC2C3Cc4ccc(OCCN5CCOCC5)c5c4C2(CCN3)C(C1)O5

C1=CC2C3Cc4ccc(OCCN5CCOCC5)c5c4C2(CCN3)C(C1)O5

6 rings, 27 atoms.

13 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.

Pholcodine citrate suppliers

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Pholcodine citrate 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

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 Pholcodine citrate is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Pholcodine citrate, based on the data on this page

What is Pholcodine citrate?

Pholcodine citrate is a chemical substance with the molecular formula C29H38N2O11 and a molar mass of 590.63 g/mol. Its CAS registry number is 14053-60-2.

What is the CAS number of Pholcodine citrate?

The CAS registry number of Pholcodine citrate is 14053-60-2.

What is the molecular formula and weight of Pholcodine citrate?

The molecular formula of Pholcodine citrate is C29H38N2O11 and its molar mass is 590.63 g/mol.

What is Pholcodine citrate used for?

Known uses and roles of Pholcodine citrate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Pholcodine citrate hazardous?

No GHS hazard classification for Pholcodine citrate 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 Pholcodine citrate?

Pholcodine citrate is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Pholcodine citrate?

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

What is the price of Pholcodine citrate?

Suppliers quote Pholcodine citrate 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

Practical guides that help when you source, ship or handle Pholcodine citrate

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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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