Rivenprost

CAT: 0013-GTR19191610-02Size: 500 ug (2.22 mM x 500 μ l in methyl acetate)Dry Ice: NoHazardous: No

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CAT#:0013-GTR19191610-02Size:500 ug (2.22 mM x 500 μ l in methyl acetate)

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Description

Rivenprost

CAS Number

256382-08-8

Field of Research

Immunology & Inflammation, Pharmacology & Drug Discovery

Smiles

C (=C/[C@H] (CC1=CC (COC) =CC=C1) O) \[C@@H]2[C@@H] (CCSCCCC (OC) =O) C (=O) C[C@H]2O

Molecular Formula

C24H34O6S

Molecular Weight

450.59

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Methyl 4-((2-((1R,2R,3R)-3-hydroxy-2-((1E,3S)-3-hydroxy-4-(3-(methoxymethyl)phenyl)-1-buten-1-yl)-5-oxocyclopentyl)ethyl)thio)butanoate

Rivenprost is a benzyl ether.

CAS Number	256382-08-8
PubChem CID	9803828
IUPAC Name	methyl 4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxocyclopentyl]ethylsulfanyl]butanoate
Molecular Formula	C24H34O6S
Molecular Weight	450.6
XLogP	1.8
Topological Polar Surface Area	118
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	14
Heavy Atom Count	31
Formal Charge	0
Complexity	580

SMILES

COCC1=CC=CC(=C1)C[C@@H](/C=C/[C@H]2[C@@H](CC(=O)[C@@H]2CCSCCCC(=O)OC)O)O

InChI

InChI=1S/C24H34O6S/c1-29-16-18-6-3-5-17(13-18)14-19(25)8-9-20-21(23(27)15-22(20)26)10-12-31-11-4-7-24(28)30-2/h3,5-6,8-9,13,19-22,25-26H,4,7,10-12,14-16H2,1-2H3/b9-8+/t19-,20-,21-,22-/m1/s1

InChIKey

FBQUXLIJKPWCAO-AZIFJQEOSA-N

Chemical Structure

2D Structure

CAS: 256382-08-8

CID: 9803828

Formula: C24H34O6S

MW: 450.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	450.6
XLogP3	1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	14
Exact Mass	450.20760997
Monoisotopic Mass	450.20760997
Topological Polar Surface Area	118 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	580
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5784983	Rivenprost

Rivenprost

Chemical Information

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