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CHEBI:209860 - 7-methoxy-7'-hydroxyepicoccin G

ChEBI IDCHEBI:209860
ChEBI Name7-methoxy-7'-hydroxyepicoccin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28N2O8S2
Net Charge0
Average Mass500.595
Monoisotopic Mass500.12871
SMILESCO[C@H]1CC(=O)[C@@H]2C[C@@]3(SC)C(=O)N4[C@@H]5[C@@H](O)[C@@H](O)CC(=O)[C@@H]5C[C@@]4(SC)C(=O)N3[C@@H]2[C@H]1O
InChIInChI=1S/C21H28N2O8S2/c1-31-13-5-11(25)9-7-21(33-3)18(29)22-14-8(10(24)4-12(26)16(14)27)6-20(22,32-2)19(30)23(21)15(9)17(13)28/h8-9,12-17,26-28H,4-7H2,1-3H3/t8-,9-,12-,13-,14-,15-,16-,17-,20+,21+/m0/s1
InChIKeyULPPOZLZRYHEOH-SVLDSPCQSA-N
Species of MetaboliteComponentSourceComments
Epicoccum (ncbitaxon:104397) - PubMed (32183021)
ChEBI Ontology
Outgoing Relation(s)
7-methoxy-7'-hydroxyepicoccin G (CHEBI:209860) has functional parent α-amino acid (CHEBI:33704)
7-methoxy-7'-hydroxyepicoccin G (CHEBI:209860) is a organonitrogen compound (CHEBI:35352)
7-methoxy-7'-hydroxyepicoccin G (CHEBI:209860) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,4S,5R,6S,9R,11R,14S,15R,16S,19R)-5,6,15-trihydroxy-16-methoxy-1,11-bis(methylsulanyl)-3,13-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosane-2,8,12,18-tetrone