Arthropsatriol B (CHEBI:197759)

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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	Arthropsatriol B

ChEBI ID	CHEBI:197759

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H18O4

Net Charge

Average Mass

226.272

Monoisotopic Mass

226.12051

InChI

InChI=1S/C12H18O4/c1-3-4-8-5-6-9(14)12(16)10(8)11(15)7(2)13/h3-6,8-12,14-16H,1-2H3/b4-3+/t8-,9-,10+,11?,12+/m0/s1

InChIKey

ZUVDWANJVVXNTN-HSCVWOFMSA-N

SMILES

O=C(C(O)[C@H]1[C@H](C=C[C@@H]([C@H]1O)O)/C=C/C)C

Metabolite of Species	Details
Arthropsis truncata (NCBI:txid1341168)	See: DOI

ChEBI Ontology
Outgoing	Arthropsatriol B (CHEBI:197759) is a secondary α-hydroxy ketone (CHEBI:2468)

IUPAC Name

1-[(1S,2S,5S,6S)-5,6-dihydroxy-2-[(E)-prop-1-enyl]cyclohex-3-en-1-yl]-1-hydroxypropan-2-one