2-oxo-4-((E)-3-oxo-4-phenoxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-5-yl [1,1'-biphenyl]-4-carboxylate, (3AR,4R,5R,6aS)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H26O6
Molecular Weight	482.5238
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2-oxo-4-((E)-3-oxo-4-phenoxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-5-yl [1,1'-biphenyl]-4-carboxylate, (3AR,4R,5R,6aS)-

Structure Search

SMILES

[H][C@]12C[C@@H](OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)[C@H](\C=C\C(=O)COC5=CC=CC=C5)[C@@]1([H])CC(=O)O2

InChI

InChIKey=QIUIWNPDEYSFOY-GWCFIWEJSA-N

InChI=1S/C30H26O6/c31-23(19-34-24-9-5-2-6-10-24)15-16-25-26-17-29(32)35-28(26)18-27(25)36-30(33)22-13-11-21(12-14-22)20-7-3-1-4-8-20/h1-16,25-28H,17-19H2/b16-15+/t25-,26-,27-,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H26O6
Molecular Weight	482.5238
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:53:37 GMT 2023` Edited by `admin` on `Sat Dec 16 19:53:37 GMT 2023`
Record UNII	C2U852A7PT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-oxo-4-((E)-3-oxo-4-phenoxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-5-yl [1,1'-biphenyl]-4-carboxylate, (3AR,4R,5R,6aS)-

Systematic Name

English

[1,1′-Biphenyl]-4-carboxylic acid, hexahydro-2-oxo-4-(3-oxo-4-phenoxy-1-butenyl)-2H-cyclopenta[b]furan-5-yl ester, [3aR-[3aα,4α(E),5β,6aα]]-

Systematic Name

English

[(3aR,4R,5R,6aS)-2-oxo-4-[(E)-3-oxo-4-phenoxy-but-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate

Systematic Name

English

(3AR,4R,5R,6aS)-2-oxo-4-((E)-3-oxo-4-phenoxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-5-yl [1,1'-biphenyl]-4-carboxylate

Systematic Name

English

Code System Code Type Description

PUBCHEM

69974146

Created by admin on Sat Dec 16 19:53:37 GMT 2023 , Edited by admin on Sat Dec 16 19:53:37 GMT 2023

PRIMARY

CAS

54382-70-6

Created by admin on Sat Dec 16 19:53:37 GMT 2023 , Edited by admin on Sat Dec 16 19:53:37 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

C2U852A7PT

Created by admin on Sat Dec 16 19:53:37 GMT 2023 , Edited by admin on Sat Dec 16 19:53:37 GMT 2023

PRIMARY

CAS

79171-99-6

Created by admin on Sat Dec 16 19:53:37 GMT 2023 , Edited by admin on Sat Dec 16 19:53:37 GMT 2023

PRIMARY