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(-) -Holostyligone

CAT: 1410-M31398-01Size: 1 EachDry Ice: NoHazardous: No
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Description
(-) -Holostyligone is a natural product.
CAS Number
887501-28-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
356.41
Molecular Formula
C21H24O5
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

(-)-Holostyligone

(-)-Holostyligone has been reported in Schisandra arisanensis and Aristolochia holostylis with data available.

CAS Number887501-28-2
PubChem CID46883472
IUPAC Name(2S,3S,4R)-4-(4-hydroxy-3-methoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-3,4-dihydro-2H-naphthalen-1-one
Molecular FormulaC21H24O5
Molecular Weight356.4
XLogP4
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity495
SMILES
C[C@@H]1[C@@H](C(=O)C2=CC(=C(C=C2[C@H]1C3=CC(=C(C=C3)O)OC)OC)OC)C
InChI
InChI=1S/C21H24O5/c1-11-12(2)21(23)15-10-19(26-5)18(25-4)9-14(15)20(11)13-6-7-16(22)17(8-13)24-3/h6-12,20,22H,1-5H3/t11-,12+,20-/m1/s1
InChIKey
LBJCQKYBKIAWHJ-XAAFQQQXSA-N
Chemical Structure
2D Structure
2D structure of (-)-Holostyligone
CAS: 887501-28-2
CID: 46883472
Formula: C21H24O5
MW: 356.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight356.4
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass356.16237386
Monoisotopic Mass356.16237386
Topological Polar Surface Area65 Ų
Heavy Atom Count26
Formal Charge0
Complexity495
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes