CYMARIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H44O9
Molecular Weight	548.665
Optical Activity	UNSPECIFIED
Defined Stereocenters	12 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(C[C@H](OC)[C@H](O)[C@@H](C)O1)O[C@H]2CC[C@]3(C=O)[C@@]4([H])CC[C@]5(C)[C@H](CC[C@]5(O)[C@]4([H])CC[C@]3(O)C2)C6=CC(=O)OC6

InChI

InChIKey=XQCGNURMLWFQJR-ZNDDOCHDSA-N

InChI=1S/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3/t17-,19+,20-,21+,22-,23+,25+,26-,27-,28+,29+,30+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H44O9
Molecular Weight	548.665
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 12
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/3821940

Cymarin (or cymarine or k-strophanthidin-alpha) is a cardiac glycoside and an anti-arrhythmia and cardiotonic agent. Cymarin works as an inhibitor of Na+ /K+-ATPase . This inhibition has an inotropic effect on the cardiac muscles increasing their force by approximately 100%.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Sodium/potassium-transporting ATPase 39 Target ID: CHEMBL2095186 Sources: https://www.ncbi.nlm.nih.gov/pubmed/6146536	Inhibitor 8297

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
Cardiotonic effect of Apocynum venetum L. extracts on isolated guinea pig atrium.	2009 Apr	19002560

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Other

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:50:35 GMT 2023` Edited by `admin` on `Fri Dec 15 18:50:35 GMT 2023`
Record UNII	UK3LS8435E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CYMARIN

Common Name

English

CYMARIN [MI]

Common Name

English

Cymarin [WHO-DD]

Common Name

English

CYMARINE

Common Name

English

K-STROPHANTHIN-ALPHA

Common Name

English

K-STROPHANTHIN-.ALPHA.

Common Name

English

3.BETA.-((2,6-DIDEOXY-3-O-METHYL-.BETA.-D-RIBO-HEXOPYRANOSYL)OXY)-5,14-DIHYDROXY-19-OXO-5.BETA.,14.BETA.-CARD-20(22)-ENOLIDE

Common Name

English

NSC-7522

Code

English

CYMARIN [MART.]

Common Name

English

Classification Tree Code System Code

WHO-ATC

C01AC03