Gabosine E (CHEBI:221374)

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ChEBI Ontology

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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	Gabosine E

ChEBI ID	CHEBI:221374

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C7H10O5

Net Charge

Average Mass

174.152

Monoisotopic Mass

174.05282

InChI

InChI=1S/C7H10O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h1,4,6-9,11-12H,2H2/t4-,6-,7-/m0/s1

InChIKey

DEJZWTDEKQRWLD-QTSITTDLSA-N

SMILES

O=C1C(=C[C@H](O)[C@@H]([C@H]1O)O)CO

ChEBI Ontology
Outgoing	Gabosine E (CHEBI:221374) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(4S,5S,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)cyclohex-2-en-1-one