CHEBI:202510 - Isariotin D

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Isariotin D
ChEBI ID CHEBI:202510
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H29NO6
Net Charge 0
Average Mass 367.442
Monoisotopic Mass 367.19949
InChI InChI=1S/C19H29NO6/c1-2-3-4-5-6-7-8-9-12(21)20-11-10-19(25)17(24)13(14(11)22)15(23)16-18(19)26-16/h8-9,11,13-16,18,22-23,25H,2-7,10H2,1H3,(H,20,21)/b9-8+/t11-,13-,14-,15-,16-,18-,19+/m0/s1
InChIKey RPNMQCNKXLDNIP-NONCFBCESA-N
SMILES O=C1[C@@]2(O)[C@H]3O[C@H]3[C@H]([C@@H]1[C@@H](O)[C@H](C2)NC(=O)/C=C/CCCCCCC)O
Metabolite of Species Details
Isaria (NCBI:txid72232) See: PubMed
ChEBI Ontology
Outgoing Isariotin D (CHEBI:202510) is a oxacycle (CHEBI:38104)
IUPAC Name
(E)-N-[(1S,2S,4S,5S,6S,7R,8S)-1,5,7-trihydroxy-10-oxo-3-oxatricyclo[4.3.1.02,4]decan-8-yl]dec-2-enamide
Manual Xref Database
23311653 ChemSpider
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