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CHEBI:216901 - Sporminarin B

ChEBI IDCHEBI:216901
ChEBI NameSporminarin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H60O8
Net Charge0
Average Mass608.857
Monoisotopic Mass608.42882
SMILESCCC(C)C[C@]1(C)C[C@H](C)[C@@H](O)[C@](C)(/C=C(\C)C(O)C(C)/C=C/C(O)C(C)/C=C/C(O)C(C)/C=C/C(O)C(C)C(=O)O)O1
InChIInChI=1S/C35H60O8/c1-11-21(2)18-34(9)19-26(7)32(40)35(10,43-34)20-25(6)31(39)24(5)14-16-29(37)22(3)12-15-28(36)23(4)13-17-30(38)27(8)33(41)42/h12-17,20-24,26-32,36-40H,11,18-19H2,1-10H3,(H,41,42)/b15-12+,16-14+,17-13+,25-20+/t21?,22?,23?,24?,26-,27?,28?,29?,30?,31?,32+,34+,35-/m0/s1
InChIKeySDGAVESVAMQGSA-IXLWIRMLSA-N
Species of MetaboliteComponentSourceComments
Preussia minimoides (ncbitaxon:269686) - DOI (10.1038/ja.2006.70)
ChEBI Ontology
Outgoing Relation(s)
Sporminarin B (CHEBI:216901) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(4E,8E,12E,16E)-3,7,11,15-tetrahydroxy-17-[(2S,3R,4S,6R)-3-hydroxy-2,4,6-trimethyl-6-(2-methylbutyl)oxan-2-yl]-2,6,10,14,16-pentamethylheptadeca-4,8,12,16-tetraenoic acid
Manual XrefsDatabases
17243448ChemSpider