CHEBI:232484 - 2-deacetyl,3-deglucopyranosyl-fuscoatroside

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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 2-deacetyl,3-deglucopyranosyl-fuscoatroside
ChEBI ID CHEBI:232484
Definition Major microspecies at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C30H49O4
Net Charge -1
Average Mass 473.719
Monoisotopic Mass 473.36363
InChI InChI=1S/C30H50O4/c1-17(2)18(3)27(6)14-15-29(8)20-10-11-22-26(4,5)24(32)21(31)16-28(22,7)19(20)12-13-30(29,9)23(27)25(33)34/h17-18,21-24,31-32H,10-16H2,1-9H3,(H,33,34)/p-1/t18-,21-,22+,23-,24+,27-,28-,29-,30+/m1/s1
InChIKey GQYGAAYZUOAUGM-YHRBPPEESA-M
SMILES C1[C@@]2(C=3CC[C@@]4([C@](C3CC[C@]2(C([C@H]([C@@H]1O)O)(C)C)[H])(C)CC[C@@]([C@H]4C([O-])=O)([C@@H](C(C)C)C)C)C)C
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-deacetyl,3-deglucopyranosyl-fuscoatroside (CHEBI:232484) has role fungal metabolite (CHEBI:76946)
2-deacetyl,3-deglucopyranosyl-fuscoatroside (CHEBI:232484) is a carboxylic acid anion (CHEBI:29067)
2-deacetyl,3-deglucopyranosyl-fuscoatroside (CHEBI:232484) is a triterpenoid (CHEBI:36615)
Synonym Source
2-deacetyl,3-deglucopyranosyl-fuscoatroside UniProt
Citation Type Source
38654452 PubMed citation SUBMITTER