LABRADIMIL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C49H75N15O12S
Molecular Weight	1098.278
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]1(C[C@@H](O)CN1C(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC3=CC=CS3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@H](CN[C@@H](CCCNC(N)=N)C(O)=O)CC5=CC=C(OC)C=C5

InChI

InChIKey=IDXCXSCCZNCXCL-XMADEQCMSA-N

InChI=1S/C49H75N15O12S/c1-76-31-14-12-28(13-15-31)21-29(24-57-34(47(74)75)9-3-17-56-49(53)54)59-43(70)37-10-4-18-62(37)45(72)36(27-65)61-41(68)35(23-32-7-6-20-77-32)60-40(67)25-58-42(69)39-22-30(66)26-64(39)46(73)38-11-5-19-63(38)44(71)33(50)8-2-16-55-48(51)52/h6-7,12-15,20,29-30,33-39,57,65-66H,2-5,8-11,16-19,21-27,50H2,1H3,(H,58,69)(H,59,70)(H,60,67)(H,61,68)(H,74,75)(H4,51,52,55)(H4,53,54,56)/t29-,30+,33-,34-,35-,36-,37-,38-,39-/m0/s1

HIDE SMILES / InChI

Description
Sources: https://www.ncbi.nlm.nih.gov/mesh/67089876 | https://www.ncbi.nlm.nih.gov/pubmed/7965719 | https://www.ncbi.nlm.nih.gov/pubmed/7931623

LABRADIMIL, a synthetic bradykinin analog, is a potent bradykinin B2 receptor agonist. It increases vascular permeability by the activation of B2 receptors on the vascular endothelium. It also selectively increases uptake of molecular tracers in brain tumors.

Originator

Approval Year

PubMed

Title	Date	PubMed
Intra-arterial administration of carboplatin and the blood brain barrier permeabilizing agent, RMP-7: a toxicologic evaluation in swine.	1998 Jan	9525816

Name

Type

Language

LABRADIMIL

Official Name

English

labradimil [INN]

Common Name

English

RMP-7

Code

English

LOBRADIMIL

Common Name

English

(S-(R*,R*))-L-ARGINYL-L-PROLYL-TRANS-4-HYDROXY-L-PROLYLGLYCYL-3-(2-THIENYL)-L-ALANYL-L-SERYL-N-(2-((4-(AMINOIMINOMETHYL)AMINO)-1-CARBOXYBUTYL)AMINO)-1-((4-METHOXYPHENYL)METHYL)ETHYL)-L-PROLINAMIDE

Common Name

English

N(SUP 2)2-((S)-2-(L-ARGINYL-L-PROLYL-TRANS-4-HYDROXY-L-PROLYGLYCYL-3-(2-THIENYL)-L-ALANYL-L-SERYL-L-PROLINAMIDO)-3-(P-METHOXYPHENYL)PROPYL)-L-ARGININE

Common Name

English

LABRADIMIL [USAN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2140