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CHEBI:224586 - Cervinomycin B1

ChEBI IDCHEBI:224586
ChEBI NameCervinomycin B1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H23NO9
Net Charge0
Average Mass529.501
Monoisotopic Mass529.13728
SMILESCOc1cc2oc3c(c(=O)c2cc1OC)C(=O)C1=C(CCc2cc4c(c(O)c21)C(=O)N1CCO[C@]1(C)C4)C3=O
InChIInChI=1S/C29H23NO9/c1-29-11-13-8-12-4-5-14-21(19(12)25(33)20(13)28(35)30(29)6-7-38-29)26(34)22-23(31)15-9-17(36-2)18(37-3)10-16(15)39-27(22)24(14)32/h8-10,33H,4-7,11H2,1-3H3/t29-/m1/s1
InChIKeyAPYVASIBUQYAAL-GDLZYMKVSA-N
ChEBI Ontology
Outgoing Relation(s)
Cervinomycin B1 (CHEBI:224586) is a xanthones (CHEBI:51149)
IUPAC Name 
(10R)-3-hydroxy-23,24-dimethoxy-10-methyl-9,20-dioxa-6-azaheptacyclo[15.12.0.02,14.04,12.06,10.019,28.021,26]nonacosa-1(17),2,4(12),13,19(28),21,23,25-octaene-5,18,27,29-tetrone