Homoplantaginin

CAT: 1407-AB1442Size: 20 mgDry Ice: NoHazardous: No

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CAT#:1407-AB1442Size:20 mg

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CAS Number

17680-84-1

Purity

98% (HPLC)

Molecular Formula

C22H22O11

Molecular Weight

462.407

Chemical Information

Homoplantaginin

Homoplantaginin is a glycoside and a member of flavonoids.

CAS Number	17680-84-1
PubChem CID	5318083
IUPAC Name	5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular Formula	C22H22O11
Molecular Weight	462.4
XLogP	0.8
Topological Polar Surface Area	175
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	5
Heavy Atom Count	33
Formal Charge	0
Complexity	721

SMILES

COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

InChI

InChI=1S/C22H22O11/c1-30-21-14(32-22-20(29)19(28)17(26)15(8-23)33-22)7-13-16(18(21)27)11(25)6-12(31-13)9-2-4-10(24)5-3-9/h2-7,15,17,19-20,22-24,26-29H,8H2,1H3/t15-,17-,19+,20-,22-/m1/s1

InChIKey

GCLAFEGUXXHIFT-IWLDQSELSA-N

Chemical Structure

2D Structure

CAS: 17680-84-1

CID: 5318083

Formula: C22H22O11

MW: 462.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	462.4
XLogP3	0.8
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	5
Exact Mass	462.11621151
Monoisotopic Mass	462.11621151
Topological Polar Surface Area	175 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	721
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BA3533-25	Homoplantaginin
HY-N1949R	Homoplantaginin (Standard)
A15607-10	Homoplantaginin 10mg
A15607-200	Homoplantaginin 200mg
A15607-100	Homoplantaginin 100mg
A15607-50	Homoplantaginin 50mg
A15607-25	Homoplantaginin 25mg
A15607-1	Homoplantaginin 1mg

Homoplantaginin

Chemical Information

Alternative Products

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