CARGUTOCIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H65N11O12
Molecular Weight	916.032
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@@H]1NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)CCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O

InChI

InChIKey=YHKWDHMRGAMOKU-DACMYBEBSA-N

InChI=1S/C42H65N11O12/c1-5-23(4)36-42(65)51-27(15-16-31(43)55)39(62)52-30(19-32(44)56)40(63)50-26(37(60)47-21-35(59)49-28(17-22(2)3)38(61)46-20-33(45)57)9-7-6-8-10-34(58)48-29(41(64)53-36)18-24-11-13-25(54)14-12-24/h11-14,22-23,26-30,36,54H,5-10,15-21H2,1-4H3,(H2,43,55)(H2,44,56)(H2,45,57)(H,46,61)(H,47,60)(H,48,58)(H,49,59)(H,50,63)(H,51,65)(H,52,62)(H,53,64)/t23-,26-,27-,28-,29-,30-,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H65N11O12
Molecular Weight	916.032
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	1
Optical Activity	UNSPECIFIED

Description
Sources: http://www.kegg.jp/dbget-bin/www_bget?dr:D09797
Curator's Comment: Description was created based on several sources, including http://www.ncbi.nlm.nih.gov/pubmed/1152307 and 10.1007/978-94-011-4439-1 Retrieved from Concise Dictionary of Pharmacological Agents: Properties and Synonyms. By I.K. Morton, Judith M. Hall, p.67

Cargutocin is an uterotonic. It is Oxytocin analog and it targets oxytocin receptor. Oxytocic activity in pregnant rats and rabbits was weak in comparison with oxytocin.

Originator

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Oxytocin receptor 19 Target ID: CHEMBL2049 Sources: http://www.kegg.jp/dbget-bin/www_bget?dr:D09797	Agonist 2678

Conditions

Condition	Modality	Targets	Highest Phase	Product
Labor complications 8 Sources: http://www.ncbi.nlm.nih.gov/pubmed/1152307	Primary		Basic research	Unknown Approved Use Unknown

PubMed

Title	Date	PubMed
Studies on pharmacological and biochemical properties of deamino-dicarba-[GLY-7]-oxytocin (Y-5350).	1975 Feb	1152307

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:03:49 GMT 2023` Edited by `admin` on `Fri Dec 15 18:03:49 GMT 2023`
Record UNII	1RJ33Z503O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CARGUTOCIN

Official Name

English

CARGUTOCIN [MI]

Common Name

English

STATOCIN

Brand Name

English

OXYTOCIN, 1-BUTYRIC ACID-6-(L-2-AMINOBUTYRIC ACID)-7-GLYCINE-

Common Name

English

Y-5350

Code

English

cargutocin [INN]

Common Name

English

CARGUTOCIN [JAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C548