SQ-28668

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H32O4
Molecular Weight	384.5085
Optical Activity	( + / - )
Defined Stereocenters	6 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]([C@@H](O)\C=C\[C@H]1[C@@H]2CC[C@@H](O2)[C@H]1C\C=C/CCCC(O)=O)C3=CC=CC=C3

InChI

InChIKey=VGRCPALIWBYEPM-GOVTYUDBSA-N

InChI=1S/C24H32O4/c1-17(18-9-5-4-6-10-18)21(25)14-13-20-19(22-15-16-23(20)28-22)11-7-2-3-8-12-24(26)27/h2,4-7,9-10,13-14,17,19-23,25H,3,8,11-12,15-16H2,1H3,(H,26,27)/b7-2-,14-13+/t17-,19+,20-,21+,22-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H32O4
Molecular Weight	384.5085
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 `Tue Apr 01 17:31:59 GMT 2025` Edited by `admin` on `Tue Apr 01 17:31:59 GMT 2025`
Record UNII	AU1MEC3WBR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-HEPTENOIC ACID, 7-((1S,2R,3S,4R)-3-((1E,3R,4S)-3-HYDROXY-4-PHENYL-1-PENTEN-1-YL)-7-OXABICYCLO(2.2.1)HEPT-2-YL)-, (5Z)-REL-

Preferred Name

English

SQ-28668

Common Name

English

REL-(5Z)-7-((1S,2R,3S,4R)-3-((1E,3R,4S)-3-HYDROXY-4-PHENYL-1-PENTEN-1-YL)-7-OXABICYCLO(2.2.1)HEPT-2-YL)-5-HEPTENOIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

AU1MEC3WBR

Created by admin on Tue Apr 01 17:31:59 GMT 2025 , Edited by admin on Tue Apr 01 17:31:59 GMT 2025

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CAS

87983-63-9

Created by admin on Tue Apr 01 17:31:59 GMT 2025 , Edited by admin on Tue Apr 01 17:31:59 GMT 2025

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PUBCHEM

14656569

Created by admin on Tue Apr 01 17:31:59 GMT 2025 , Edited by admin on Tue Apr 01 17:31:59 GMT 2025

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