SSR-240612

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H52N4O7S.ClH
Molecular Weight	793.411
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.COC1=CC=C2C=C(C=CC2=C1)S(=O)(=O)N[C@H](CC(=O)N[C@H](CC3=CC=C(CN4[C@@H](C)CCC[C@H]4C)C=C3)C(=O)N(C)C(C)C)C5=CC=C6OCOC6=C5

InChI

InChIKey=GLHHFOSVBQQNAW-GDYXXZBVSA-N

InChI=1S/C42H52N4O7S.ClH/c1-27(2)45(5)42(48)38(20-30-10-12-31(13-11-30)25-46-28(3)8-7-9-29(46)4)43-41(47)24-37(34-16-19-39-40(23-34)53-26-52-39)44-54(49,50)36-18-15-32-21-35(51-6)17-14-33(32)22-36;/h10-19,21-23,27-29,37-38,44H,7-9,20,24-26H2,1-6H3,(H,43,47);1H/t28-,29+,37-,38-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C42H52N4O7S
Molecular Weight	756.95
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Activation of TRPV1 by capsaicin induces functional kinin B(1) receptor in rat spinal cord microglia.	2012 Jan 20	22264228

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:14:18 GMT 2023` Edited by `admin` on `Fri Dec 15 19:14:18 GMT 2023`
Record UNII	OY7B59FYJE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SSR-240612

Common Name

English

SSR 240612

Common Name

English

(2R)-2-(((3R)-3-(1,3-BENZODIOXOL-5-YL)-3-(((6-METHOXY-2-NAPHTHYL)SULFONYL)AMINO)PROPANOYL)AMINO)-3-(4-(((2R,6S)-2,6-DIMETHYLPIPERIDINYL)METHYL)PHENYL)-N-ISOPROPYL-N-METHYLPROPANAMIDE HYDROCHLORIDE

Common Name

English

SSR240612

Common Name

English

D-PHENYLALANINAMIDE, (3R)-3-(1,3-BENZODIOXOL-5-YL)-N-((6-METHOXY-2-NAPHTHALENYL)SULFONYL)-.BETA.-ALANYL-4-(((2R,6S)-2,6-DIMETHYL-1-PIPERIDINYL)METHYL)-N-METHYL-N-(1-METHYLETHYL)-, HYDROCHLORIDE (1:1)

Common Name

English

Code System Code Type Description

CAS

464930-42-5