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CHEBI:210290 - Terpestacin B

ChEBI IDCHEBI:210290
ChEBI NameTerpestacin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H38O5
Net Charge0
Average Mass418.574
Monoisotopic Mass418.27192
SMILESC/C1=C\C[C@]2(C)C(=O)C(O)=C([C@H](C)CO)[C@H]2C/C=C(\C)[C@@H]2CC[C@@](C)(O2)[C@@H](O)CC1
InChIInChI=1S/C25H38O5/c1-15-6-9-20(27)25(5)13-11-19(30-25)16(2)7-8-18-21(17(3)14-26)22(28)23(29)24(18,4)12-10-15/h7,10,17-20,26-28H,6,8-9,11-14H2,1-5H3/b15-10+,16-7+/t17-,18-,19+,20+,24+,25-/m1/s1
InChIKeyLAJNGEKHZMZDRF-ZPIROSACSA-N
Species of MetaboliteComponentSourceComments
Arthrinium (ncbitaxon:112177) - DOI (10.1007/s10600-019-02667-x)
ChEBI Ontology
Outgoing Relation(s)
Terpestacin B (CHEBI:210290) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1S,2E,5R,9S,11E,15S,16R)-7,15-dihydroxy-6-[(2S)-1-hydroxypropan-2-yl]-2,9,12,16-tetramethyl-19-oxatricyclo[14.2.1.05,9]nonadeca-2,6,11-trien-8-one
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75320577ChemSpider