CHEBI:208656 - SMTP-0

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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 SMTP-0
ChEBI ID CHEBI:208656
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H31NO4
Net Charge 0
Average Mass 385.504
Monoisotopic Mass 385.22531
InChI InChI=1S/C23H31NO4/c1-14(2)7-5-8-15(3)9-6-10-23(4)20(26)12-17-19(25)11-16-18(21(17)28-23)13-24-22(16)27/h7,9,11,20,25-26H,5-6,8,10,12-13H2,1-4H3,(H,24,27)/t20-,23-/m0/s1
InChIKey XGUHYRYUXUVLOK-REWPJTCUSA-N
SMILES O=C1NCC2=C1C=C(O)C3=C2O[C@]([C@@H](O)C3)(CCC=C(CCC=C(C)C)C)C
Metabolite of Species Details
Stachybotrys microspora (NCBI:txid80391) See: PubMed
ChEBI Ontology
Outgoing SMTP-0 (CHEBI:208656) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(2S,3S)-2-(4,8-dimethylnona-3,7-dienyl)-3,5-dihydroxy-2-methyl-3,4,8,9-tetrahydropyrano[2,3-e]isoindol-7-one
Manual Xref Database
78437924 ChemSpider
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