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Screening compounds

(+)-6a-Hydroxymaackiain

Also known as (6Ar,12ar)-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]chromene-3,6a(12ah)-diol, (1R,12R)-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene-1,16-diol, (6aR,12aR)-6H-(1,3)dioxolo(5,6)(1)benzofuro(3,2-c)chromene-3,6a(12aH)-diol

CAS 14602-93-8Formula C16H12O6Molar mass 300.27 g/mol
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(+)-6a-Hydroxymaackiain chemical structure, C16H12O6, CAS 14602-93-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
14602-93-8
Formula
C16H12O6
Molar mass
300.27 g/mol
HS code
293299
Category
Screening compounds

What is (+)-6a-Hydroxymaackiain?

Plain description, key identifiers and synonyms

(+)-6a-hydroxymaackiain is a member of the class of pterocarpans that is (6aS,11aS)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene which is substituted by a hydroxy group at position 3, a second hydroxy group at position 6a (resulting in the CIP stereochemical designation changing to R,R), and a methylenedioxy group at positions 8-9. It is a metabolite of the pea phytoalexin (+)-pisatin, produced by the pea-pathogenic Fusarium oxysporum forma specialis pisi, and a number of other fungi, including Fusarium anruioides, Fusarium avenaceum, Mycosphaerella pinodes, and Stemphylium botryosum. It is a member of pterocarpans and a tertiary alcohol. It is functionally related to a (+)-maackiain.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,12R)-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene-1,16-diol
CAS number
14602-93-8
Molecular formula
C16H12O6
InChIKey
GLMPLZUBQDAZEN-CVEARBPZSA-N
InChI
InChI=1S/C16H12O6/c17-8-1-2-9-11(3-8)19-6-16(18)10-4-13-14(21-7-20-13)5-12(10)22-15(9)16/h1-5,15,17-18H,6-7H2/t15-,16+/m1/s1
Canonical SMILES
Oc1ccc2c(c1)OCC1(O)c3cc4c(cc3OC21)OCO4
Isomeric SMILES
C1[C@]2([C@@H](C3=C(O1)C=C(C=C3)O)OC4=CC5=C(C=C42)OCO5)O

Synonyms

  • (6Ar,12ar)-6H-[1,3]dioxolo[5,6][1]benzofuro[3,2-c]chromene-3,6a(12ah)-diol
  • (1R,12R)-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaene-1,16-diol
  • (6aR,12aR)-6H-(1,3)dioxolo(5,6)(1)benzofuro(3,2-c)chromene-3,6a(12aH)-diol
  • (1R,12R)-5,7,11,19-tetraoxapentacyclo(10.8.0.02,10.04,8.013,18)icosa-2,4(8),9,13(18),14,16-hexaene-1,16-diol
  • 3,6a-Dihydroxy-8,9-methylenedioxypterocarpan
  • O-demethylpisatin
  • (+)-O-demethylpisatin
  • (6aR,12aR)-6H,9H-[1,3]Dioxolo[5,6][1]benzofuro[3,2-c][1]benzopyran-3,6a(12aH)-diol
  • (6aR,12aR)-6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c][1]benzopyran-3,6a(12aH)-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
300.27 g/molcalc.
Exact mass
300.0634 Dacalc.
LogP (octanol/water)
1.83calc.
Topological polar surface area
77.38 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
0calc.
Heavy atoms
22calc.
Rings
5calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.25calc.
Formal charge
0calc.
Stereocentres
2calc.
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, c1ccc2c(c1)OCC1c3cc4c(cc3OC21)OCO4

c1ccc2c(c1)OCC1c3cc4c(cc3OC21)OCO4

5 rings, 20 atoms.

29 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.

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(+)-6a-Hydroxymaackiain price

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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 (+)-6a-Hydroxymaackiain 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 (+)-6a-Hydroxymaackiain is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about (+)-6a-Hydroxymaackiain, based on the data on this page

What is (+)-6a-Hydroxymaackiain?

(+)-6a-hydroxymaackiain is a member of the class of pterocarpans that is (6aS,11aS)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene which is substituted by a hydroxy group at position 3, a second hydroxy group at position 6a (resulting in the CIP stereochemical designation changing to R,R), and a methylenedioxy group at…

What is the CAS number of (+)-6a-Hydroxymaackiain?

The CAS registry number of (+)-6a-Hydroxymaackiain is 14602-93-8.

What is the molecular formula and weight of (+)-6a-Hydroxymaackiain?

The molecular formula of (+)-6a-Hydroxymaackiain is C16H12O6 and its molar mass is 300.27 g/mol.

What is (+)-6a-Hydroxymaackiain used for?

Known uses and roles of (+)-6a-Hydroxymaackiain include building blocks in research and laboratory and screening compounds in research and laboratory.

Is (+)-6a-Hydroxymaackiain hazardous?

No GHS hazard classification for (+)-6a-Hydroxymaackiain 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 (+)-6a-Hydroxymaackiain?

(+)-6a-Hydroxymaackiain 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 (+)-6a-Hydroxymaackiain?

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What is the price of (+)-6a-Hydroxymaackiain?

Suppliers quote (+)-6a-Hydroxymaackiain on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

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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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