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Interiorin C

CAT: 0013-GTR19233636-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19233636-03Size:10 mg
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Description
Interiorin C, the principal bioactive lignan from Schisandra chinensis, is a key marker for its hematopoietic-enhancing properties. Its research applications focus on studying antioxidant and immunomodulatory mechanisms in both in vitro cellular models and in vivo hematopoiesis studies.
CAS Number
133360-39-1
Smiles
O (C) C=1C23C=4C (OC2) =C5C (=CC4C (OC (C) =O) C (C) C (C) CC3=CC (=O) C1OC) OCO5
Molecular Formula
C24H26O8
Molecular Weight
442.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Interiorin C
CAS Number133360-39-1
PubChem CID14755543
IUPAC Name(19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.01,16.04,21.05,9]henicosa-4(21),5(9),10,16,19-pentaen-12-yl) acetate
Molecular FormulaC24H26O8
Molecular Weight442.5
XLogP2.9
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity877
SMILES
CC1CC2=CC(=O)C(=C(C23COC4=C3C(=CC5=C4OCO5)C(C1C)OC(=O)C)OC)OC
InChI
InChI=1S/C24H26O8/c1-11-6-14-7-16(26)20(27-4)23(28-5)24(14)9-29-22-18(24)15(8-17-21(22)31-10-30-17)19(12(11)2)32-13(3)25/h7-8,11-12,19H,6,9-10H2,1-5H3
InChIKey
NYEXLGIZLUIIRN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Interiorin C
CAS: 133360-39-1
CID: 14755543
Formula: C24H26O8
MW: 442.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight442.5
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass442.16276778
Monoisotopic Mass442.16276778
Topological Polar Surface Area89.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity877
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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