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Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H52N4O7S
Molecular Weight	756.95
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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=QGWIQIAWOCJRPI-WSCVWKGISA-N

InChI=1S/C42H52N4O7S/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)/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

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 16:23:32 GMT 2023` Edited by `admin` on `Fri Dec 15 16:23:32 GMT 2023`
Record UNII	189R4J5E0F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SSR-240612 FREE BASE

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)-

Common Name

English

1,3-BENZODIOXOLE-5-PROPANAMIDE, N-((1R)-1-((4-(((2R,6S)-2,6-DIMETHYL-1-PIPERIDINYL)METHYL)PHENYL)METHYL)-2-(METHYL(1-METHYLETHYL)AMINO)-2-OXOETHYL)-.BETA.-(((6-METHOXY-2-NAPHTHALENYL)SULFONYL)AMINO)-,(.BETA.R)-

Common Name

English

SSR240612 FREE BASE

Common Name

English

Code System Code Type Description

PUBCHEM

9853583

Created by admin on Fri Dec 15 16:23:32 GMT 2023 , Edited by admin on Fri Dec 15 16:23:32 GMT 2023

PRIMARY

CAS

465539-70-2