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Dactylarin

CAT: 0013-GTR19200399-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200399-03Size:50 mg
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Description
Dactylarin is a cytotoxic antibiotic isolated from Dactylaria lutea that exerts its inhibitory effects on glycolytic enzymes through interaction with thiol groups. This mechanism supports its application in biochemical research, particularly in studies of cancer cell metabolism and energy pathways in vitro.
CAS Number
22350-90-9
Field of Research
Infectious Disease & Virology
Smiles
COc1cc (O) c2C (=O) C3=C (C[C@] (C) (O) [C@H] (O) C3) C (=O) c2c1
Molecular Formula
C16H16O6
Molecular Weight
304.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dactylarin

Altersolanol B is a member of hydroxyanthraquinones.

CAS Number22350-90-9
PubChem CID161389
IUPAC Name(2R,3S)-2,3,8-trihydroxy-6-methoxy-3-methyl-2,4-dihydro-1H-anthracene-9,10-dione
Molecular FormulaC16H16O6
Molecular Weight304.29
XLogP0.9
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count22
Formal Charge0
Complexity553
SMILES
C[C@@]1(CC2=C(C[C@H]1O)C(=O)C3=C(C2=O)C=C(C=C3O)OC)O
InChI
InChI=1S/C16H16O6/c1-16(21)6-10-8(5-12(16)18)15(20)13-9(14(10)19)3-7(22-2)4-11(13)17/h3-4,12,17-18,21H,5-6H2,1-2H3/t12-,16+/m1/s1
InChIKey
AAHQQIFXAQHGBD-WBMJQRKESA-N
Chemical Structure
2D Structure
2D structure of Dactylarin
CAS: 22350-90-9
CID: 161389
Formula: C16H16O6
MW: 304.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight304.29
XLogP30.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass304.09468823
Monoisotopic Mass304.09468823
Topological Polar Surface Area104 Ų
Heavy Atom Count22
Formal Charge0
Complexity553
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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