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Gymnopusin

CAT: 0013-GTR19240745-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19240745-01Size:10 mg
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Description
GYMNOPUSIN is a phenanthrene natural product isolated from Maxillaria densa. It acts as a root growth inhibitor in Amaranthus hypochondriacus seedlings, exhibiting in vitro IC50 values of 330 and 58.2 μM, making it a candidate for plant physiology and allelopathy research.
CAS Number
113476-61-2
Smiles
OC=1C=CC=2C (C1) =C (OC) C=C3C=C (O) C (OC) =C (OC) C32
Molecular Formula
C17H16O5
Molecular Weight
300.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3,4,9-Trimethoxy-2,7-phenanthrenediol

gymnopusin has been reported in Maxillaria densa, Bulbophyllum gymnopus, and Bulbophyllum reptans with data available.

CAS Number113476-61-2
PubChem CID14505894
IUPAC Name3,4,9-trimethoxyphenanthrene-2,7-diol
Molecular FormulaC17H16O5
Molecular Weight300.30
XLogP3.6
Topological Polar Surface Area68.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity376
SMILES
COC1=CC2=CC(=C(C(=C2C3=C1C=C(C=C3)O)OC)OC)O
InChI
InChI=1S/C17H16O5/c1-20-14-7-9-6-13(19)16(21-2)17(22-3)15(9)11-5-4-10(18)8-12(11)14/h4-8,18-19H,1-3H3
InChIKey
GIVSZLKTIBWYRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4,9-Trimethoxy-2,7-phenanthrenediol
CAS: 113476-61-2
CID: 14505894
Formula: C17H16O5
MW: 300.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.30
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass300.09977361
Monoisotopic Mass300.09977361
Topological Polar Surface Area68.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity376
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TN8373-01Gymnopusin

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