CHEBI:222652 - Hygrophamide

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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 Hygrophamide
ChEBI ID CHEBI:222652
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C42H83NO5
Net Charge 0
Average Mass 682.128
Monoisotopic Mass 681.62712
InChI InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h23-24,38-41,44-47H,3-22,25-37H2,1-2H3,(H,43,48)/b24-23-/t38?,39-,40-,41+/m1/s1
InChIKey CFZHDWRCMXJUGC-YOJDDEEFSA-N
SMILES O=C(NC([C@H](O)[C@H](O)CCCCCCCCCCCCCC)CO)[C@H](O)CCCCCC/C=C\CCCCCCCCCCCCCC
Metabolite of Species Details
Hygrophorus (NCBI:txid71941) See: DOI
ChEBI Ontology
Outgoing Hygrophamide (CHEBI:222652) is a secondary alcohol (CHEBI:35681)
IUPAC Name
(Z,2R)-2-hydroxy-N-[(3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]tetracos-9-enamide
Manual Xref Database
78439967 ChemSpider
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