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CHEBI:211357 - Fridamycin I

ChEBI IDCHEBI:211357
ChEBI NameFridamycin I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H33NO10
Net Charge0
Average Mass591.613
Monoisotopic Mass591.21045
SMILESC[C@@H]1O[C@@H](Oc2cccc3c2C(=O)c2ccc(C[C@@](C)(O)CC(=O)NCc4ccccc4)c(O)c2C3=O)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C32H33NO10/c1-16-25(35)29(39)30(40)31(42-16)43-21-10-6-9-19-23(21)27(37)20-12-11-18(26(36)24(20)28(19)38)13-32(2,41)14-22(34)33-15-17-7-4-3-5-8-17/h3-12,16,25,29-31,35-36,39-41H,13-15H2,1-2H3,(H,33,34)/t16-,25-,29+,30+,31-,32+/m0/s1
InChIKeyLMFFSGSNQUAOLE-DGYAPBEZSA-N
Species of MetaboliteComponentSourceComments
Actinokineosporaspecies (ncbitaxon:1872133) - PubMed (30680548)
ChEBI Ontology
Outgoing Relation(s)
Fridamycin I (CHEBI:211357) is a anthraquinone (CHEBI:22580)
IUPAC Name 
(3R)-N-benzyl-3-hydroxy-4-[1-hydroxy-9,10-dioxo-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyanthracen-2-yl]-3-methylbutanamide
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73930448ChemSpider