CHEBI:83267 - filipin III

ChEBI IDCHEBI:83267
ChEBI Namefilipin III
Stars
DefinitionA macrolide that is the major component of a mixture of four isomeric polyene macrolides isolated from Streptomyces filipinensis.
Last Modified10 October 2014
SubmitterSteve
DownloadsMolfile
FormulaC35H58O11
Net Charge0
Average Mass654.838
Monoisotopic Mass654.39791
SMILES[H][C@]1([C@H](O)CCCCC)C(=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/C35H58O11/c1-4-5-11-16-31(42)34-33(44)22-29(40)20-27(38)18-25(36)17-26(37)19-28(39)21-32(43)23(2)14-12-9-7-6-8-10-13-15-30(41)24(3)46-35(34)45/h6-10,12-15,24-34,36-44H,4-5,11,16-22H2,1-3H3/b7-6+,10-8+,12-9+,15-13+,23-14+/t24-,25+,26-,27+,28-,29+,30+,31-,32+,33+,34-/m1/s1
InChIKeyIMQSIXYSKPIGPD-YQRUMEKGSA-N
Species of MetaboliteComponentSourceComments
Streptomyces filipinensis (ncbitaxon:66887) - PubMed (5453318)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
Application:
fluorescent probe  A role played by a fluorescent molecular entity used to study the microscopic environment by fluorescence spectroscopy.
ChEBI Ontology
Outgoing Relation(s)
filipin III (CHEBI:83267) has role bacterial metabolite (CHEBI:76969)
filipin III (CHEBI:83267) has role fluorescent probe (CHEBI:39442)
filipin III (CHEBI:83267) is a macrolide (CHEBI:25106)
filipin III (CHEBI:83267) is a olefinic compound (CHEBI:78840)
filipin III (CHEBI:83267) is a polyol (CHEBI:26191)
IUPAC Name 
(3R,4S,6S,8S,10R,12R,14R,16S,17E,19E,21E,23E,25E,27S,28R)-4,6,8,10,12,14,16,27-octahydroxy-3-[(1R)-1-hydroxyhexyl]-17,28-dimethyloxacyclooctacosa-17,19,21,23,25-pentaen-2-one
INNs  Source
filipinumChemIDplus
filipinaChemIDplus
filipineChemIDplus
Synonyms  Source
FilipinChemIDplus
FilimarisinChemIDplus
14-DeoxylagosinChemIDplus
Manual XrefsDatabases
D04186KEGG DRUG
C00018791KNApSAcK
Registry NumbersSources
Reaxys:7326798Reaxys
CAS:480-49-9KEGG DRUG
CAS:480-49-9ChemIDplus
Citations