Iso-cladospolide B (CHEBI:197765)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Iso-cladospolide B

ChEBI ID	CHEBI:197765

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H20O4

Net Charge

Average Mass

228.288

Monoisotopic Mass

228.13616

InChI

InChI=1S/C12H20O4/c1-9(13)5-3-2-4-6-10(14)11-7-8-12(15)16-11/h7-11,13-14H,2-6H2,1H3/t9-,10-,11-/m0/s1

InChIKey

XQIRBHFARGUNIX-DCAQKATOSA-N

SMILES

O=C1O[C@H]([C@@H](O)CCCCC[C@@H](O)C)C=C1

ChEBI Ontology
Outgoing	Iso-cladospolide B (CHEBI:197765) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name

(2S)-2-[(1S,7S)-1,7-dihydroxyoctyl]-2H-uran-5-one