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CHEBI:211031 - Trichaspside C

ChEBI IDCHEBI:211031
ChEBI NameTrichaspside C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H37NO7
Net Charge0
Average Mass427.538
Monoisotopic Mass427.25700
SMILESCC(=O)N[C@H]1[C@@H](OC(C)C[C@H]2C[C@H](C)[C@H]3CCC(C)=C[C@H]3O2)O[C@H](CO)[C@@H](O)[C@@H]1O
InChIInChI=1S/C22H37NO7/c1-11-5-6-16-12(2)8-15(29-17(16)7-11)9-13(3)28-22-19(23-14(4)25)21(27)20(26)18(10-24)30-22/h7,12-13,15-22,24,26-27H,5-6,8-10H2,1-4H3,(H,23,25)/t12-,13?,15+,16+,17+,18+,19+,20+,21+,22-/m0/s1
InChIKeyVRMQEAKUIZSPBV-OHYUYLOTSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (31048011)
ChEBI Ontology
Outgoing Relation(s)
Trichaspside C (CHEBI:211031) is a N-acyl-hexosamine (CHEBI:21656)
IUPAC Name 
N-[(2S,3R,4R,5S,6R)-2-[1-[(2R,4S,4aR,8aS)-4,7-dimethyl-3,4,4a,5,6,8a-hexahydro-2H-chromen-2-yl]propan-2-yloxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
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73950463ChemSpider