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CHEBI:214002 - Terpestacin C

ChEBI IDCHEBI:214002
ChEBI NameTerpestacin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H42O4
Net Charge0
Average Mass406.607
Monoisotopic Mass406.30831
SMILESC/C1=C/C[C@]2(C)[C@H](O)[C@H](O)[C@@H]([C@H](C)CO)[C@H]2C/C=C(\C)[C@@H](O)CC/C(C)=C/CC1
InChIInChI=1S/C25H42O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-24,26-29H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13-,18-10+/t19-,20-,21+,22+,23-,24-,25+/m1/s1
InChIKeyLTSFUUJKRVARPQ-MKLCNSNJSA-N
Species of MetaboliteComponentSourceComments
Aplosporella javeedii (ncbitaxon:1346708) - PubMed (32512149)
ChEBI Ontology
Outgoing Relation(s)
Terpestacin C (CHEBI:214002) is a organic hydroxy compound (CHEBI:33822)
IUPAC Name 
(1R,3E,5S,8E,12E,15S,16S,17R,18R)-18-[(2S)-1-hydroxypropan-2-yl]-4,8,12,15-tetramethylbicyclo[13.3.0]octadeca-3,8,12-triene-5,16,17-triol