CHEBI:214378 - Globosumoside B

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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 Globosumoside B
ChEBI ID CHEBI:214378
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H25ClO9
Net Charge 0
Average Mass 420.840
Monoisotopic Mass 420.11871
InChI InChI=1S/C18H25ClO9/c1-4-5-9-13(19)11(25-3)6-10(21)17(9)28-18-16(24)15(23)14(22)12(27-18)7-26-8(2)20/h6,12,14-16,18,21-24H,4-5,7H2,1-3H3/t12-,14-,15+,16-,18+/m1/s1
InChIKey NTEZYMKIQJSWPQ-NDOBWRGRSA-N
SMILES ClC1=C(OC)C=C(O)C(=C1CCC)O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)COC(=O)C
Metabolite of Species Details
Chaetomium elatum (NCBI:txid5150) See: PubMed
ChEBI Ontology
Outgoing Globosumoside B (CHEBI:214378) is a glycoside (CHEBI:24400)
IUPAC Name
[(2R,3S,4S,5R,6S)-6-(3-chloro-6-hydroxy-4-methoxy-2-propylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Manual Xref Database
78441332 ChemSpider
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