Neposide

CAT: 0931-T125265-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0931-T125265-02Size:5 mg

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CAS Number

23140-69-4

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Others

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Bioactivity

Neposide is a useful organic compound for research related to life sciences. The catalog number is T125265 and the CAS number is 23140-69-4.

Smiles

CC(=O)c1c(C)cc2cccc(O)c2c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Molecular Formula

C19H22O8

Molecular Weight

378.377

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

1-[8-hydroxy-3-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone

1-[8-hydroxy-3-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone is a glycoside.

CAS Number	23140-69-4
PubChem CID	12313291
IUPAC Name	1-[8-hydroxy-3-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone
Molecular Formula	C19H22O8
Molecular Weight	378.4
XLogP	0.7
Topological Polar Surface Area	137
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Heavy Atom Count	27
Formal Charge	0
Complexity	528

SMILES

CC1=CC2=C(C(=CC=C2)O)C(=C1C(=O)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

InChI

InChI=1S/C19H22O8/c1-8-6-10-4-3-5-11(22)14(10)18(13(8)9(2)21)27-19-17(25)16(24)15(23)12(7-20)26-19/h3-6,12,15-17,19-20,22-25H,7H2,1-2H3/t12-,15-,16+,17-,19+/m1/s1

InChIKey

DNABNTQMDXKPON-ZIIYPAMZSA-N

Chemical Structure

2D Structure

CAS: 23140-69-4

CID: 12313291

Formula: C19H22O8

MW: 378.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	378.4
XLogP3	0.7
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	4
Exact Mass	378.13146766
Monoisotopic Mass	378.13146766
Topological Polar Surface Area	137 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	528
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
MBS5790748	Neposide

Neposide

Chemical Information

Alternative Products

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