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CHEBI:208658 - Penitalarin A

ChEBI IDCHEBI:208658
ChEBI NamePenitalarin A
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FormulaC23H34O4
Net Charge0
Average Mass374.521
Monoisotopic Mass374.24571
SMILESCC[C@H](C)/C=C/C=C(\C)C[C@@H](C)/C=C/C=C/[C@@H]1O[C@@H](C(=O)OC)[C@@H]2O[C@]12C
InChIInChI=1S/C23H34O4/c1-7-16(2)12-10-13-18(4)15-17(3)11-8-9-14-19-23(5)21(27-23)20(26-19)22(24)25-6/h8-14,16-17,19-21H,7,15H2,1-6H3/b11-8+,12-10+,14-9+,18-13+/t16-,17-,19-,20+,21-,23+/m0/s1
InChIKeyMZRAWKILROXKNJ-AJJQXUGXSA-N
ChEBI Ontology
Outgoing Relation(s)
Penitalarin A (CHEBI:208658) is a dioxanes (CHEBI:46926)
IUPAC Name 
methyl (1S,2R,4S,5R)-5-methyl-4-[(1E,3E,5R,7E,9E,11S)-5,7,11-trimethyltrideca-1,3,7,9-tetraenyl]-3,6-dioxabicyclo[3.1.0]hexane-2-carboxylate
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63002538ChemSpider