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CHEBI:208949 - Cyclizidine I

ChEBI IDCHEBI:208949
ChEBI NameCyclizidine I
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SubmitterMetaboLights
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FormulaC17H28ClNO4
Net Charge0
Average Mass345.867
Monoisotopic Mass345.17069
SMILESC/C(=C/C=C/CCO)C[C@H]1[C@H](O)[C@@](C)(O)[C@H]2[C@H](O)[C@@H](Cl)CCN12
InChIInChI=1S/C17H28ClNO4/c1-11(6-4-3-5-9-20)10-13-16(22)17(2,23)15-14(21)12(18)7-8-19(13)15/h3-4,6,12-16,20-23H,5,7-10H2,1-2H3/b4-3+,11-6-/t12-,13-,14+,15+,16-,17-/m0/s1
InChIKeyVHNNDXMHAPLFIS-VQZDQMHOSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies HNA39 (ncbitaxon:2850561) - PubMed (29389122)
ChEBI Ontology
Outgoing Relation(s)
Cyclizidine I (CHEBI:208949) is a indolizines (CHEBI:38485)
IUPAC Name 
(1S,2S,3S,7S,8S,8aR)-7-chloro-3-[(2Z,4E)-7-hydroxy-2-methylhepta-2,4-dienyl]-1-methyl-3,5,6,7,8,8a-hexahydro-2H-indolizine-1,2,8-triol
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64849037ChemSpider