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CHEBI:219773 - Filipin II

ChEBI IDCHEBI:219773
ChEBI NameFilipin II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H58O10
Net Charge0
Average Mass638.839
Monoisotopic Mass638.40300
SMILESCCCCCC[C@H]1C(=O)O[C@H](C)[C@@H](O)/C=C/C=C/C=C/C=C/C=C(\C)[C@@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@@H]1O
InChIInChI=1S/C35H58O10/c1-4-5-6-13-16-31-34(43)23-30(40)21-28(38)19-26(36)18-27(37)20-29(39)22-33(42)24(2)15-12-10-8-7-9-11-14-17-32(41)25(3)45-35(31)44/h7-12,14-15,17,25-34,36-43H,4-6,13,16,18-23H2,1-3H3/b8-7+,11-9+,12-10+,17-14+,24-15+/t25-,26+,27-,28+,29-,30+,31-,32+,33+,34+/m1/s1
InChIKeyYMIXNQVKVPYZHL-YWSRBNGNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces filipinensis (ncbitaxon:66887) - PubMed (5453318)
ChEBI Ontology
Outgoing Relation(s)
Filipin II (CHEBI:219773) is a macrolide (CHEBI:25106)
IUPAC Name 
(3R,4S,6S,8S,10R,12R,14R,16S,17E,19E,21E,23E,25E,27S,28R)-3-hexyl-4,6,8,10,12,14,16,27-octahydroxy-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one
Manual XrefsDatabases
68004078ChemSpider