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Tricin 5-gucoside

CAT: 0926-HBA76900-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0926-HBA76900-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
32769-00-9
Smiles
COC1=CC (=CC (=C1O) OC) C2=CC (=O) C3=C (O2) C=C (C=C3OC4C (C (C (C (O4) CO) O) O) O) O
Molecular Formula
C23H24O12
Molecular Weight
492.4 g/mol
Controlled
No

Chemical Information

Tricin 5-glucoside

Tricin 5-O-beta-D-glucoside is a glycosyloxyflavone that is 3',5'-di-O-methyltricetin (tricin) in which the phenolic hydrogen at position 5 has been replaced by a beta-D-glucopyranosyl group. It has a role as a plant metabolite. It is a beta-D-glucoside, a dimethoxyflavone, a polyphenol, a dihydroxyflavone, a glycosyloxyflavone and a monosaccharide derivative. It is functionally related to a 3',5'-di-O-methyltricetin.

CAS Number32769-00-9
PubChem CID49800176
IUPAC Name7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC23H24O12
Molecular Weight492.4
XLogP0.3
Topological Polar Surface Area185
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Heavy Atom Count35
Formal Charge0
Complexity762
SMILES
COC1=CC(=CC(=C1O)OC)C2=CC(=O)C3=C(O2)C=C(C=C3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
InChI
InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)12-7-11(26)18-13(33-12)5-10(25)6-14(18)34-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3/t17-,20-,21+,22-,23-/m1/s1
InChIKey
FLSOTPIEFVBPBU-LDBVRRDLSA-N
Chemical Structure
2D Structure
2D structure of Tricin 5-glucoside
CAS: 32769-00-9
CID: 49800176
Formula: C23H24O12
MW: 492.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight492.4
XLogP30.3
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Exact Mass492.12677620
Monoisotopic Mass492.12677620
Topological Polar Surface Area185 Ų
Heavy Atom Count35
Formal Charge0
Complexity762
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TSW-00167-01Tricin 5-gucoside
HY-N1127-01Tricin
HY-N1127STricin-d6
HY-N1127R-01Tricin (Standard)
HY-111812-01Tricin 7-O-glucuronide
MBS5787658Tricin 7-O-glucoside
M38552Tricin-7-O-rutinoside

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