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CHEBI:225951 - Amiaspochalasin B

ChEBI IDCHEBI:225951
ChEBI NameAmiaspochalasin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H35NO4
Net Charge0
Average Mass401.547
Monoisotopic Mass401.25661
SMILESCC1=CCC[C@H](O)C[C@@H]2C(=O)O[C@@]34C(=O)N[C@@H](CC(C)C)[C@@H]3[C@H](C)C(C)=C[C@@H]4[C@@H]12
InChIInChI=1S/C24H35NO4/c1-12(2)9-19-21-15(5)14(4)10-18-20-13(3)7-6-8-16(26)11-17(20)22(27)29-24(18,21)23(28)25-19/h7,10,12,15-21,26H,6,8-9,11H2,1-5H3,(H,25,28)/t15-,16+,17+,18-,19+,20+,21+,24-/m1/s1
InChIKeyDKJFRKAZQYSNMC-URGYEAKNSA-N
Species of MetaboliteComponentSourceComments
Aspergillus micronesiensis (ncbitaxon:1507543) - PubMed (30997804)
ChEBI Ontology
Outgoing Relation(s)
Amiaspochalasin B (CHEBI:225951) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1R,4S,6S,11R,12R,15S,16S,17S)-6-hydroxy-10,14,15-trimethyl-17-(2-methylpropyl)-2-oxa-18-azatetracyclo[10.7.0.01,16.04,11]nonadeca-9,13-diene-3,19-dione