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CHEBI:224055 - Amphiepicoccin G

ChEBI IDCHEBI:224055
ChEBI NameAmphiepicoccin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20N2O7S3
Net Charge0
Average Mass484.577
Monoisotopic Mass484.04326
SMILESCO[C@@H]1[C@H](O)[C@@H]2[C@H]3C[C@@]4(S[C@@H]1C3=O)C(=O)N1[C@@H]3[C@@H](O)[C@@H]5CC(=O)[C@@H]3C[C@@]1(SS5)C(=O)N24
InChIInChI=1S/C19H20N2O7S3/c1-28-14-13(25)10-6-4-18(29-15(14)11(6)23)16(26)21-9-5-3-19(21,17(27)20(10)18)31-30-8(12(9)24)2-7(5)22/h5-6,8-10,12-15,24-25H,2-4H2,1H3/t5-,6+,8-,9-,10-,12-,13+,14+,15+,18+,19+/m0/s1
InChIKeyKZUSTXWYNOBSTF-ICKVOYKCSA-N
Species of MetaboliteComponentSourceComments
Epicoccum (ncbitaxon:104397) - PubMed (31975590)
ChEBI Ontology
Outgoing Relation(s)
Amphiepicoccin G (CHEBI:224055) has functional parent α-amino acid (CHEBI:33704)
Amphiepicoccin G (CHEBI:224055) is a organonitrogen compound (CHEBI:35352)
Amphiepicoccin G (CHEBI:224055) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,4S,5R,6R,7S,9R,11R,14S,15R,16S,19R)-5,15-dihydroxy-6-methoxy-21,22,23-trithia-3,13-diazaheptacyclo[14.4.2.17,11.01,13.03,11.04,9.014,19]tricosane-2,8,12,18-tetrone