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CHEBI:219717 - Arixanthomycin C

ChEBI IDCHEBI:219717
ChEBI NameArixanthomycin C
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SubmitterMetaboLights
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FormulaC28H21NO9
Net Charge0
Average Mass515.474
Monoisotopic Mass515.12163
SMILESC[C@@]12Cc3cc4c(c(O)c3C(=O)N1[C@@H](C(=O)O)CO2)-c1c(cc2oc3c(O)cccc3c(=O)c2c1O)CC4
InChIInChI=1S/C28H21NO9/c1-28-9-13-7-11-5-6-12-8-17-21(22(31)14-3-2-4-16(30)25(14)38-17)24(33)19(12)18(11)23(32)20(13)26(34)29(28)15(10-37-28)27(35)36/h2-4,7-8,15,30,32-33H,5-6,9-10H2,1H3,(H,35,36)/t15-,28-/m1/s1
InChIKeyNIGFPOVBJFGJLQ-WQIZZMQYSA-N
ChEBI Ontology
Outgoing Relation(s)
Arixanthomycin C (CHEBI:219717) is a xanthones (CHEBI:51149)
IUPAC Name 
(7R,10R)-3,22,29-trihydroxy-10-methyl-5,27-dioxo-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(29),2,4(12),13,17,19(28),21(26),22,24-nonaene-7-carboxylic acid
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