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CHEBI:192929 - Hordatine B glucoside

ChEBI IDCHEBI:192929
ChEBI NameHordatine B glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H50N8O10
Net Charge0
Average Mass742.831
Monoisotopic Mass742.36499
SMILESCOc1cc(/C=C\C(=O)NCCCCN=C(N)N)cc2c1OC(c1ccc(OC3OC(CO)C(O)C(O)C3O)cc1)C2C(=O)NCCCCN=C(N)N
InChIInChI=1S/C35H50N8O10/c1-50-23-17-19(6-11-25(45)40-12-2-4-14-42-34(36)37)16-22-26(32(49)41-13-3-5-15-43-35(38)39)30(53-31(22)23)20-7-9-21(10-8-20)51-33-29(48)28(47)27(46)24(18-44)52-33/h6-11,16-17,24,26-30,33,44,46-48H,2-5,12-15,18H2,1H3,(H,40,45)(H,41,49)(H4,36,37,42)(H4,38,39,43)/b11-6-
InChIKeySKTFAQNZNWTXFP-WDZFZDKYSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS4099) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Hordatine B glucoside (CHEBI:192929) is a benzofurans (CHEBI:35259)
IUPAC Name 
N-[4-(diaminomethylideneamino)butyl]-5-[(Z)-3-[4-(diaminomethylideneamino)butylamino]-3-oxoprop-1-enyl]-7-methoxy-2-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydro-1-benzouran-3-carboxamide
Manual XrefsDatabases
HMDB0030460HMDB