KNI-10006

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H41N3O6S
Molecular Weight	631.782
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC=CC(C)=C1OCC(=O)N[C@@H](CC2=CC=CC=C2)[C@H](O)C(=O)N3CSC(C)(C)[C@H]3C(=O)N[C@@H]4[C@H](O)CC5=CC=CC=C45

InChI

InChIKey=KKTYZYHUPKXLPL-RIQJEONASA-N

InChI=1S/C35H41N3O6S/c1-21-11-10-12-22(2)31(21)44-19-28(40)36-26(17-23-13-6-5-7-14-23)30(41)34(43)38-20-45-35(3,4)32(38)33(42)37-29-25-16-9-8-15-24(25)18-27(29)39/h5-16,26-27,29-30,32,39,41H,17-20H2,1-4H3,(H,36,40)(H,37,42)/t26-,27+,29-,30-,32+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C35H41N3O6S
Molecular Weight	631.782
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:34:31 GMT 2023` Edited by `admin` on `Sat Dec 16 16:34:31 GMT 2023`
Record UNII	21BKD6T22E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

KNI-10006

Code

English

KNI10006

Code

English

4-THIAZOLIDINECARBOXAMIDE, N-((1S,2R)-2,3-DIHYDRO-2-HYDROXY-1H-INDEN-1-YL)-3-((2S,3S)-3-((2-(2,6-DIMETHYLPHENOXY)ACETYL)AMINO)-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-5,5-DIMETHYL-, (4R)-

Systematic Name

English

(4R)-N-((1S,2R)-2,3-DIHYDRO-2-HYDROXY-1H-INDEN-1-YL)-3-((2S,3S)-3-((2-(2,6-DIMETHYLPHENOXY)ACETYL)AMINO)-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-5,5-DIMETHYL-4-THIAZOLIDINECARBOXAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

9895503

Created by admin on Sat Dec 16 16:34:31 GMT 2023 , Edited by admin on Sat Dec 16 16:34:31 GMT 2023

PRIMARY

FDA UNII

21BKD6T22E

Created by admin on Sat Dec 16 16:34:31 GMT 2023 , Edited by admin on Sat Dec 16 16:34:31 GMT 2023

PRIMARY

CAS

461444-55-3

Created by admin on Sat Dec 16 16:34:31 GMT 2023 , Edited by admin on Sat Dec 16 16:34:31 GMT 2023

PRIMARY