RO-23-7553

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H38O3
Molecular Weight	410.5888
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC=C([C@H](C)CC#CC(C)(C)O)[C@@]1(C)CCC\C2=C/C=C3/C[C@@H](O)C[C@H](O)C3=C

InChI

InChIKey=JKFZMIQMKFWJAY-RQJQXFIZSA-N

InChI=1S/C27H38O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-12,18,22,24-25,28-30H,2,7-9,13,15-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,24+,25+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H38O3
Molecular Weight	410.5888
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:06:50 GMT 2023` Edited by `admin` on `Fri Dec 15 18:06:50 GMT 2023`
Record UNII	O13QTC8612
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RO-23-7553

Common Name

English

ILX-23-7553

Code

English

ILEX-23-7553

Code

English

ILX 237553 [WHO-DD]

Common Name

English

1,3-CYCLOHEXANEDIOL, 5-((2E)-2-((3AS,4E,7AS)-3,3A,5,6,7,7A-HEXAHYDRO-1-((1R)-5-HYDROXY-1,5-DIMETHYL-3-HEXYN-1-YL)-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-4-METHYLENE-, (1R,3S,5Z)-

Systematic Name

English

ILX-237553

Code

English

BXL-353

Code

English

Code System Code Type Description

CAS

118694-43-2