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CHEBI:209956 - Oxichaetoglobosin A/B

ChEBI IDCHEBI:209956
ChEBI NameOxichaetoglobosin A/B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H38N2O6
Net Charge0
Average Mass546.664
Monoisotopic Mass546.27299
SMILESC/C1=C\[C@@H](C)C/C=C/[C@H]2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H](C(O)c4cnc5ccccc45)NC(=O)[C@]32C(=O)CC[C@H](O)C1=O
InChIInChI=1S/C32H38N2O6/c1-16-8-7-10-21-29-31(4,40-29)18(3)25-26(28(38)20-15-33-22-11-6-5-9-19(20)22)34-30(39)32(21,25)24(36)13-12-23(35)27(37)17(2)14-16/h5-7,9-11,14-16,18,21,23,25-26,28-29,33,35,38H,8,12-13H2,1-4H3,(H,34,39)/b10-7+,17-14+/t16-,18-,21-,23-,25-,26+,28?,29-,31+,32+/m0/s1
InChIKeyURBMFWBRXLZNIG-AQAXDUOSSA-N
ChEBI Ontology
Outgoing Relation(s)
Oxichaetoglobosin A/B (CHEBI:209956) is a indoles (CHEBI:24828)
IUPAC Name 
(1R,5S,7E,9S,11E,13R,14S,16R,17S,18R,19R)-5-hydroxy-19-[hydroxy(1H-indol-3-yl)methyl]-7,9,16,17-tetramethyl-15-oxa-20-azatetracyclo[11.8.0.01,18.014,16]henicosa-7,11-diene-2,6,21-trione
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