ILOPROST S-ISOMER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H32O4
Molecular Weight	360.4871
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC#CC[C@H](C)[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(C[C@H]12)=C/CCCC(O)=O

InChI

InChIKey=HIFJCPQKFCZDDL-ITQKTNNISA-N

InChI=1S/C22H32O4/c1-3-4-7-15(2)20(23)11-10-18-19-13-16(8-5-6-9-22(25)26)12-17(19)14-21(18)24/h8,10-11,15,17-21,23-24H,5-7,9,12-14H2,1-2H3,(H,25,26)/b11-10+,16-8+/t15-,17-,18+,19-,20+,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H32O4
Molecular Weight	360.4871
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:28:16 GMT 2025` Edited by `admin` on `Mon Mar 31 18:28:16 GMT 2025`
Record UNII	45U5P0UB24
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ILOPROST S-ISOMER

Common Name

English

(5E)-5-((3AS,4R,5R,6AS)-5-HYDROXY-4-((1E,3S,4S)-3-HYDROXY-4-METHYLOCT-1-EN-6-YN-1-YL)HEXAHYDROPENTALEN-2(1H)-YLIDENE)PENTANOIC ACID

Preferred Name

English

PENTANOIC ACID, 5-((3AS,4R,5R,6AS)-HEXAHYDRO-5-HYDROXY-4-((1E,3S,4S)-3-HYDROXY-4-METHYL-1-OCTEN-6-YNYL)-2(1H)-PENTALENYLIDENE)-, (5E)-

Common Name

English

Code System Code Type Description

PUBCHEM

11639089

Created by admin on Mon Mar 31 18:28:16 GMT 2025 , Edited by admin on Mon Mar 31 18:28:16 GMT 2025

PRIMARY

CAS

74843-14-4

Created by admin on Mon Mar 31 18:28:16 GMT 2025 , Edited by admin on Mon Mar 31 18:28:16 GMT 2025

PRIMARY

FDA UNII

45U5P0UB24

Created by admin on Mon Mar 31 18:28:16 GMT 2025 , Edited by admin on Mon Mar 31 18:28:16 GMT 2025

PRIMARY

EPA CompTox

DTXSID20225814

Created by admin on Mon Mar 31 18:28:16 GMT 2025 , Edited by admin on Mon Mar 31 18:28:16 GMT 2025

PRIMARY

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