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Cannabisin G

CAT: 0013-GTR19218067-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19218067-01Size:5 mg
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Description
Cannabisin G is a lignanamide compound for research use, particularly in immunology and pharmacology. In vitro studies suggest it may modulate immune responses, supporting its investigation as a potential immunomodulatory agent for conditions involving immune system dysfunction.
CAS Number
163136-20-7
Smiles
C (\C (=C/C1=CC (OC) =C (O) C=C1) \C (NCCC2=CC=C (O) C=C2) =O) (=C\C3=CC (OC) =C (O) C=C3) /C (NCCC4=CC=C (O) C=C4) =O
Molecular Formula
C36H36N2O8
Molecular Weight
624.68
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cannabisin G

Cannabisin G has been reported in Mitrephora thorelii, Berberis vulgaris, and other organisms with data available.

CAS Number163136-20-7
PubChem CID10438919
IUPAC Name(2E,3E)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methylidene]-N,N'-bis[2-(4-hydroxyphenyl)ethyl]butanediamide
Molecular FormulaC36H36N2O8
Molecular Weight624.7
XLogP5.4
Topological Polar Surface Area158
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Heavy Atom Count46
Formal Charge0
Complexity937
SMILES
COC1=C(C=CC(=C1)/C=C(/C(=O)NCCC2=CC=C(C=C2)O)\C(=C/C3=CC(=C(C=C3)O)OC)\C(=O)NCCC4=CC=C(C=C4)O)O
InChI
InChI=1S/C36H36N2O8/c1-45-33-21-25(7-13-31(33)41)19-29(35(43)37-17-15-23-3-9-27(39)10-4-23)30(20-26-8-14-32(42)34(22-26)46-2)36(44)38-18-16-24-5-11-28(40)12-6-24/h3-14,19-22,39-42H,15-18H2,1-2H3,(H,37,43)(H,38,44)/b29-19+,30-20+
InChIKey
FGAVHWSCPSBSMG-CZYCKNNWSA-N
Chemical Structure
2D Structure
2D structure of Cannabisin G
CAS: 163136-20-7
CID: 10438919
Formula: C36H36N2O8
MW: 624.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight624.7
XLogP35.4
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Exact Mass624.24716611
Monoisotopic Mass624.24716611
Topological Polar Surface Area158 Ų
Heavy Atom Count46
Formal Charge0
Complexity937
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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