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CHEBI:219711 - Arixanthomycin B

ChEBI IDCHEBI:219711
ChEBI NameArixanthomycin B
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FormulaC29H23NO9
Net Charge0
Average Mass529.501
Monoisotopic Mass529.13728
SMILESCc1c2c(c(O)c3c(=O)c4cccc(O)c4oc13)-c1c(cc3c(c1O)C(=O)N1[C@@H](C(=O)O)CO[C@]1(C)C3)CC2
InChIInChI=1S/C29H23NO9/c1-11-14-7-6-12-8-13-9-29(2)30(16(10-38-29)28(36)37)27(35)19(13)23(33)18(12)20(14)24(34)21-22(32)15-4-3-5-17(31)26(15)39-25(11)21/h3-5,8,16,31,33-34H,6-7,9-10H2,1-2H3,(H,36,37)/t16-,29-/m1/s1
InChIKeyAHGAWEHPVFEMKO-HYDGNGQDSA-N
ChEBI Ontology
Outgoing Relation(s)
Arixanthomycin B (CHEBI:219711) is a xanthones (CHEBI:51149)
IUPAC Name 
(7R,10R)-3,22,29-trihydroxy-10,18-dimethyl-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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