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Screening compounds

2''-Hydroxycannabidiol

Also known as 2''-hydroxy-CBD, 2''-HO-cannabidiol, 2''-OH-cannabidiol

CAS 53413-22-2Formula C21H30O3Molar mass 330.47 g/mol
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2''-Hydroxycannabidiol chemical structure, C21H30O3, CAS 53413-22-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
53413-22-2
Formula
C21H30O3
Molar mass
330.47 g/mol
HS code
290729
Category
Screening compounds

What is 2''-Hydroxycannabidiol?

Plain description, key identifiers and synonyms

2''-hydroxycannabidiol is a hydroxy-cannabidiol that is cannabidiol in which one of the two hydrogens at position 2 of the pentyl chain has been replaced by a hydroxy group. It is a metabolite of cannabidiol by human liver microsomes, produced by CYP3A. It has a role as a human xenobiotic metabolite. It is a hydroxy-cannabidiol, a member of resorcinols, a secondary alcohol and an olefinic compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-(2-hydroxypentyl)-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]benzene-1,3-diol
CAS number
53413-22-2
Molecular formula
C21H30O3
UNII
7V535ST6LR
InChIKey
PVRJAZVKVQMBIZ-UQJFVLDMSA-N
InChI
InChI=1S/C21H30O3/c1-5-6-16(22)10-15-11-19(23)21(20(24)12-15)18-9-14(4)7-8-17(18)13(2)3/h9,11-12,16-18,22-24H,2,5-8,10H2,1,3-4H3/t16?,17-,18+/m0/s1
Canonical SMILES
C=C(C)C1CCC(C)=CC1c1c(O)cc(CC(O)CCC)cc1O
Isomeric SMILES
CCCC(CC1=CC(=C(C(=C1)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C)O)O

Synonyms

  • 2''-hydroxy-CBD
  • 2''-HO-cannabidiol
  • 2''-OH-cannabidiol
  • 2''-hydroxy-cannabidiol
  • Cannabidiol metabolite (2''-hydroxycannabidiol)
  • 2''-HO-CBD
  • 2''-OH-CBD
  • 1,3-Benzenediol, 5-(2-hydroxypentyl)-2-(3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-
  • 5-(2-Hydroxypentyl)-2-(3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-1,3-benzenediol
  • (1'R,2'R)-4-(2-hydroxypentyl)-5'-methyl-2'-(prop-1-en-2-yl)-1',2',3',4'-tetrahydrobiphenyl-2,6-diol
  • 5-(2-hydroxypentyl)-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]benzene-1,3-diol

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
330.47 g/molcalc.
Exact mass
330.2195 Dacalc.
LogP (octanol/water)
4.82calc.
Topological polar surface area
60.69 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
6calc.
Heavy atoms
24calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.52calc.
Formal charge
0calc.
Stereocentres
3calc.
Lipinski rule of five
Passes (0 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, C1=CC(c2ccccc2)CCC1

C1=CC(c2ccccc2)CCC1

2 rings, 12 atoms, the 1,2,3,4-Tetrahydro-1,1'-biphenyl ring system.

157 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.

2''-Hydroxycannabidiol suppliers

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2''-Hydroxycannabidiol 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

Roles

  • animal metabolite
  • eukaryotic metabolite
  • human metabolite
  • human xenobiotic metabolite
  • mammalian metabolite
  • metabolite
  • xenobiotic metabolite

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 2''-Hydroxycannabidiol is traded under.

HS 2907.29Indicative HS code

Polyphenols, phenol-alcohols, other

World exports in 2024
$535M
−27.0% vs 2023, imports $565M
2019 to 2024
Top exporters
  1. India * partner reported17.7%
  2. Germany16.5%
  3. Japan15.8%
Top importers
  1. United States13.1%
  2. Japan8.0%
  3. Belgium7.9%

* Partner reported figures, a lower bound.

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

The HS code shown for 2''-Hydroxycannabidiol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 2''-Hydroxycannabidiol, based on the data on this page

What is 2''-Hydroxycannabidiol?

2''-hydroxycannabidiol is a hydroxy-cannabidiol that is cannabidiol in which one of the two hydrogens at position 2 of the pentyl chain has been replaced by a hydroxy group. It is a metabolite of cannabidiol by human liver microsomes, produced by CYP3A. It has a role as a human xenobiotic metabolite.

What is the CAS number of 2''-Hydroxycannabidiol?

The CAS registry number of 2''-Hydroxycannabidiol is 53413-22-2.

What is the molecular formula and weight of 2''-Hydroxycannabidiol?

The molecular formula of 2''-Hydroxycannabidiol is C21H30O3 and its molar mass is 330.47 g/mol.

What is 2''-Hydroxycannabidiol used for?

Known uses and roles of 2''-Hydroxycannabidiol include building blocks in research and laboratory, screening compounds in research and laboratory, animal metabolite, eukaryotic metabolite, human metabolite and 4 more.

Is 2''-Hydroxycannabidiol hazardous?

No GHS hazard classification for 2''-Hydroxycannabidiol 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 2''-Hydroxycannabidiol?

2''-Hydroxycannabidiol is usually classified under HS code 290729 (Polyphenols, phenol-alcohols, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 2''-Hydroxycannabidiol?

Post a free request on CompoundList and suppliers of 2''-Hydroxycannabidiol will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 2''-Hydroxycannabidiol?

Suppliers quote 2''-Hydroxycannabidiol 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 2''-Hydroxycannabidiol

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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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