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Taxoquinone

CAT: 0804-HY-N13182Size: 1 EachDry Ice: NoHazardous: No
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Description
Taxoquinone is an antioxidant derived from Metasequoia glyptostroboides and belongs to the diterpenoid class of compounds. At a concentration of 150 μg/mL, Taxoquinone exhibits a maximum inhibition of DPPH radicals of 81.29%, demonstrating superior antioxidant activity compared to Ascorbic acid and α-tocopherol at the same concentration[1].
CAS Number
21764-41-0
UNSPSC
12352211
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/taxoquinone.html
Smiles
C[C@@]12C3=C([C@H](C[C@@]1([H])C(C)(CCC2)C)O)C(C(C(C)C)=C(C3=O)O)=O
Molecular Formula
C20H28O4
Molecular Weight
332.43
References & Citations
[1]Bajpai V K, et al. Antioxidant and free radical scavenging activities of taxoquinone, a diterpenoid isolated from Metasequoia glyptostroboides[J]. South African Journal of Botany, 2017, 111: 93-98.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Taxoquinone

Taxoquinone has been reported in Peltodon longipes, Salvia deserti, and other organisms with data available.

CAS Number21764-41-0
PubChem CID99965
IUPAC Name1,10-dihydroxy-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthrene-3,4-dione
Molecular FormulaC20H28O4
Molecular Weight332.4
XLogP3.1
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity680
SMILES
CC(C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3CC2O)(C)C)C)O
InChI
InChI=1S/C20H28O4/c1-10(2)13-16(22)14-11(21)9-12-19(3,4)7-6-8-20(12,5)15(14)18(24)17(13)23/h10-12,21-22H,6-9H2,1-5H3
InChIKey
WAZYPYJGZYLHHT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Taxoquinone
CAS: 21764-41-0
CID: 99965
Formula: C20H28O4
MW: 332.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.4
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass332.19875937
Monoisotopic Mass332.19875937
Topological Polar Surface Area74.6 Ų
Heavy Atom Count24
Formal Charge0
Complexity680
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5787379Taxoquinone

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