LITTORALISONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H28O11
Molecular Weight	504.4832
Optical Activity	UNSPECIFIED
Defined Stereocenters	14 / 14
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12[C@@H](C)C[C@@H]3OC(=O)[C@]4([C@@H]5O[C@@]1([H])O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6OC(=O)[C@@H]5[C@H]4C7=CC=C(O)C=C7)[C@]23[H]

InChI

InChIKey=NJRMZLCAZRKLEM-PIEUJLPKSA-N

InChI=1S/C25H28O11/c1-8-6-11-16-13(8)22-35-20-14(15(25(16,20)24(31)33-11)9-2-4-10(27)5-3-9)21(30)34-19-18(29)17(28)12(7-26)32-23(19)36-22/h2-5,8,11-20,22-23,26-29H,6-7H2,1H3/t8-,11-,12+,13+,14+,15+,16-,17+,18-,19+,20+,22-,23-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H28O11
Molecular Weight	504.4832
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	14 / 14
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:00:30 GMT 2023` Edited by `admin` on `Sat Dec 16 16:00:30 GMT 2023`
Record UNII	4OU8CJ93OP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LITTORALISONE

Common Name

English

LITTORALISONE [MI]

Common Name

English

(-)-LITTORALISONE

Common Name

English

2H,3H-4,8-DIOXACYCLOBUTA(E)CYCLOPENT(CD)INDENE-1-CARBOXYLIC ACID, 7-(.BETA.-D-GLUCOPYRANOSYLOXY)OCTAHYDRO-2-(4-HYDROXYPHENYL)-6-METHYL-3-OXO-, INTRAMOL. 1,2'-ESTER, (1R,2S,2AS,4AS,6S,6AR,7S,8AR)-

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m11826

Created by admin on Sat Dec 16 16:00:30 GMT 2023 , Edited by admin on Sat Dec 16 16:00:30 GMT 2023

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FDA UNII

4OU8CJ93OP

Created by admin on Sat Dec 16 16:00:30 GMT 2023 , Edited by admin on Sat Dec 16 16:00:30 GMT 2023

PRIMARY

PUBCHEM

10391419

Created by admin on Sat Dec 16 16:00:30 GMT 2023 , Edited by admin on Sat Dec 16 16:00:30 GMT 2023

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CAS

334832-08-5

Created by admin on Sat Dec 16 16:00:30 GMT 2023 , Edited by admin on Sat Dec 16 16:00:30 GMT 2023

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