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CHEBI:209035 - Virescenoside Z13

ChEBI IDCHEBI:209035
ChEBI NameVirescenoside Z13
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H42O9
Net Charge0
Average Mass510.624
Monoisotopic Mass510.28288
SMILESC=C[C@@]1(C)CCC2C(=CC[C@H]3[C@@](C)(CO[C@@H]4O[C@H](C(=O)OC)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@H](O)C[C@]23C)C1
InChIInChI=1S/C27H42O9/c1-6-25(2)10-9-15-14(11-25)7-8-17-26(15,3)12-16(28)22(32)27(17,4)13-35-24-20(31)18(29)19(30)21(36-24)23(33)34-5/h6-7,15-22,24,28-32H,1,8-13H2,2-5H3/t15?,16-,17-,18-,19+,20+,21+,22+,24-,25+,26-,27-/m1/s1
InChIKeyOUXPXJLCEJNSBY-UUKKESKESA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - PubMed (31671910)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Virescenoside Z13 (CHEBI:209035) is a steroid saponin (CHEBI:61655)
IUPAC Name 
methyl (2S,3S,4R,5S,6R)-6-[[(1S,2R,3R,4aR,7S,10aR)-7-ethenyl-2,3-dihydroxy-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-1-yl]methoxy]-3,4,5-trihydroxyoxane-2-carboxylate