KT-5926

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H27N3O6
Molecular Weight	525.5519
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@H](C(=O)OOC)[C@](C)(O1)N3C4=C(C=CC=C4)C5=C3C6=C(C7=C(C=CC(OCCC)=C7)N26)C8=C5CNC8=O

InChI

InChIKey=SLLLSIAIIFCYHO-RLDZSICGSA-N

InChI=1S/C30H27N3O6/c1-4-11-37-15-9-10-20-17(12-15)24-25-18(14-31-28(25)34)23-16-7-5-6-8-21(16)33-27(23)26(24)32(20)22-13-19(29(35)39-36-3)30(33,2)38-22/h5-10,12,19,22H,4,11,13-14H2,1-3H3,(H,31,34)/t19-,22+,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C30H27N3O6
Molecular Weight	525.5519
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Adherent neutrophils activate endothelial myosin light chain kinase: role in transendothelial migration.	1998 May	9572834
Possible involvement of optimally phosphorylated L-plastin in activation of superoxide-generating NADPH oxidase.	2003 Dec	14769871
Endothelial cell myosin light chain kinase (MLCK) regulates TNFalpha-induced NFkappaB activity.	2005 Feb 1	15526279

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:22:14 GMT 2023` Edited by `admin` on `Sat Dec 16 09:22:14 GMT 2023`
Record UNII	1YP81K304O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

KT-5926

Common Name

English

9,12-EPOXY-1H-DIINDOLO(1,2,3-FG:3',2',1'-KL)PYRROLO(3,4-I)(1,6)BENZODIAZOCINE-10-CARBOXYLIC ACID, 2,3,9,10,11,12-HEXAHYDRO-10-HYDROXY-9-METHYL-1-OXO-16-PROPOXY-, METHYL ESTER, (9S,10R,12R)-

Systematic Name

English

Code System Code Type Description

CAS

126643-38-7