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Kadsulignan L

CAT: 0804-HY-N8294Size: 1 EachDry Ice: NoHazardous: No
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Description
Kadsulignan L is a Lignans product that can be isolated from the stems of Kadsura japonica[1].
CAS Number
163660-06-8
UNSPSC
12352005
Target
HBV
Type
Natural Products
Related Pathways
Anti-infection
Applications
COVID-19-anti-virus
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/kadsulignan-l.html
Smiles
COC1=C(OC)C(OC)=CC2=C1C3=C(C4=C(C=C3C5OC2C(C5C)C)OCO4)OC
Molecular Formula
C23H26O7
Molecular Weight
414.45
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Kadsulignan L

(1S,17R,18S,19R)-9,12,13,14-tetramethoxy-18,19-dimethyl-5,7,20-trioxapentacyclo[15.2.1.02,10.04,8.011,16]icosa-2,4(8),9,11,13,15-hexaene has been reported in Kadsura interior, Kadsura heteroclita, and Kadsura angustifolia with data available.

CAS Number163660-06-8
PubChem CID44567511
IUPAC Name(1S,17R,18S,19R)-9,12,13,14-tetramethoxy-18,19-dimethyl-5,7,20-trioxapentacyclo[15.2.1.02,10.04,8.011,16]icosa-2,4(8),9,11,13,15-hexaene
Molecular FormulaC23H26O7
Molecular Weight414.4
XLogP3.9
Topological Polar Surface Area64.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity616
SMILES
C[C@@H]1[C@@H]([C@@H]2C3=CC(=C(C(=C3C4=C(C5=C(C=C4[C@H]1O2)OCO5)OC)OC)OC)OC)C
InChI
InChI=1S/C23H26O7/c1-10-11(2)19-13-8-15-21(29-9-28-15)23(27-6)17(13)16-12(18(10)30-19)7-14(24-3)20(25-4)22(16)26-5/h7-8,10-11,18-19H,9H2,1-6H3/t10-,11+,18+,19-/m0/s1
InChIKey
RNIZTMIJCBCDBR-VLSRRBAKSA-N
Chemical Structure
2D Structure
2D structure of Kadsulignan L
CAS: 163660-06-8
CID: 44567511
Formula: C23H26O7
MW: 414.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight414.4
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass414.16785316
Monoisotopic Mass414.16785316
Topological Polar Surface Area64.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity616
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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