LAPPAOL F

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H42O12
Molecular Weight	714.7543
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]4(CC1=CC2=C(O[C@@H]([C@H]2CO)C3=CC(OC)=C(O)C=C3)C(OC)=C1)COC(=O)[C@]4([H])CC5=CC6=C(O[C@@H]([C@H]6CO)C7=CC=C(O)C(OC)=C7)C(OC)=C5

InChI

InChIKey=YXNKOCZXAVTXTG-NYGVLQSXSA-N

InChI=1S/C40H42O12/c1-46-32-15-22(5-7-30(32)43)36-28(17-41)26-11-20(13-34(48-3)38(26)51-36)9-24-19-50-40(45)25(24)10-21-12-27-29(18-42)37(52-39(27)35(14-21)49-4)23-6-8-31(44)33(16-23)47-2/h5-8,11-16,24-25,28-29,36-37,41-44H,9-10,17-19H2,1-4H3/t24-,25+,28-,29-,36+,37+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C40H42O12
Molecular Weight	714.7543
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:00:40 GMT 2023` Edited by `admin` on `Sat Dec 16 11:00:40 GMT 2023`
Record UNII	5CE539C44W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LAPPAOL F

Common Name

English

2(3H)-FURANONE, 3,4-BIS(((2S,3R)-2,3-DIHYDRO-2-(4-HYDROXY-3-METHOXYPHENYL)-3-(HYDROXYMETHYL)-7-METHOXY-5-BENZOFURANYL)METHYL)DIHYDRO-, (3R,4R)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID201318593

Created by admin on Sat Dec 16 11:00:40 GMT 2023 , Edited by admin on Sat Dec 16 11:00:40 GMT 2023

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PUBCHEM

73425459

Created by admin on Sat Dec 16 11:00:40 GMT 2023 , Edited by admin on Sat Dec 16 11:00:40 GMT 2023

PRIMARY

CAS

69394-17-8

Created by admin on Sat Dec 16 11:00:40 GMT 2023 , Edited by admin on Sat Dec 16 11:00:40 GMT 2023

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FDA UNII

5CE539C44W

Created by admin on Sat Dec 16 11:00:40 GMT 2023 , Edited by admin on Sat Dec 16 11:00:40 GMT 2023

PRIMARY

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Comments:

55% Cell growth rate of M1 cells at 50 uM of compound vs control