CHEBI:204264 - Pericosine D

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Pericosine D
ChEBI ID CHEBI:204264
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H11ClO5
Net Charge 0
Average Mass 222.620
Monoisotopic Mass 222.02950
InChI InChI=1S/C8H11ClO5/c1-14-8(13)3-2-4(10)6(11)7(12)5(3)9/h2,4-7,10-12H,1H3/t4-,5-,6-,7-/m1/s1
InChIKey AEDMWQPFIPNFCS-DBRKOABJSA-N
SMILES Cl[C@@H]1C(C(=O)OC)=C[C@@H](O)[C@H]([C@@H]1O)O
Metabolite of Species Details
Periconia (NCBI:txid97971) See: DOI
ChEBI Ontology
Outgoing Pericosine D (CHEBI:204264) is a carbonyl compound (CHEBI:36586)
IUPAC Name
methyl (3R,4R,5S,6R)-6-chloro-3,4,5-trihydroxycyclohexene-1-carboxylate
Manual Xref Database
28285432 ChemSpider
View more database links