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CHEBI:205394 - Mniopetal A

ChEBI IDCHEBI:205394
ChEBI NameMniopetal A
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SubmitterMetaboLights
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FormulaC27H40O9
Net Charge0
Average Mass508.608
Monoisotopic Mass508.26723
SMILESCCCCCCCC[C@@H](OC(C)=O)C(=O)O[C@H]1CC(C)(C)[C@@H]2CC=C(C=O)[C@@H]3[C@@H](O)OC(=O)[C@@]32[C@H]1O
InChIInChI=1S/C27H40O9/c1-5-6-7-8-9-10-11-18(34-16(2)29)23(31)35-19-14-26(3,4)20-13-12-17(15-28)21-24(32)36-25(33)27(20,21)22(19)30/h12,15,18-22,24,30,32H,5-11,13-14H2,1-4H3/t18-,19+,20+,21-,22+,24+,27-/m1/s1
InChIKeyAXAFCVAELSOPHP-LFCMEJNJSA-N
ChEBI Ontology
Outgoing Relation(s)
Mniopetal A (CHEBI:205394) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(3S,3aS,6aS,9S,10R,10aR)-4-ormyl-3,10-dihydroxy-7,7-dimethyl-1-oxo-3a,6,6a,8,9,10-hexahydro-3H-benzo[d][2]benzouran-9-yl] (2R)-2-acetyloxydecanoate
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