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CHEBI:215303 - 15-deoxyoxalicine B

ChEBI IDCHEBI:215303
ChEBI Name15-deoxyoxalicine B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H33NO6
Net Charge0
Average Mass503.595
Monoisotopic Mass503.23079
SMILESC=C(C)[C@@]1(O)CC[C@@]2(C)[C@@H](CC=C(C)[C@]23Cc2c(cc(-c4cccnc4)oc2=O)O3)[C@]12CCC(=O)OC2
InChIInChI=1S/C30H33NO6/c1-18(2)29(34)12-11-27(4)24(28(29)10-9-25(32)35-17-28)8-7-19(3)30(27)15-21-23(37-30)14-22(36-26(21)33)20-6-5-13-31-16-20/h5-7,13-14,16,24,34H,1,8-12,15,17H2,2-4H3/t24-,27+,28-,29+,30-/m1/s1
InChIKeyFIWRZQROYVDBSG-LXJMSAHPSA-N
Species of MetaboliteComponentSourceComments
Penicillium decaturense (ncbitaxon:116971) - PubMed (12605512)
ChEBI Ontology
Outgoing Relation(s)
15-deoxyoxalicine B (CHEBI:215303) is a terpene lactone (CHEBI:37668)
Manual XrefsDatabases
68048308ChemSpider