CHEBI:10130 - Zygadenine

ChEBI IDCHEBI:10130
ChEBI NameZygadenine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC27H43NO7
Net Charge0
Average Mass493.641
Monoisotopic Mass493.30395
SMILES[H][C@@]12CN3C[C@@H](C)CC[C@@]3([H])[C@@](C)(O)[C@@]1([H])[C@@H](O)[C@H](O)[C@]1(O)[C@@]2([H])C[C@]23O[C@]4(O)[C@@H](O)CC[C@@]2(C)[C@]4([H])CC[C@]31[H]
InChIInChI=1S/C27H43NO7/c1-13-4-7-18-24(3,32)20-14(12-28(18)11-13)15-10-25-17(26(15,33)22(31)21(20)30)6-5-16-23(25,2)9-8-19(29)27(16,34)35-25/h13-22,29-34H,4-12H2,1-3H3/t13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23-,24+,25+,26-,27-/m0/s1
InChIKeyNPNDUIMQBJIGQS-IDFKWMMPSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Zygadenine (CHEBI:10130) is a alkaloid (CHEBI:22315)
Synonym  Source
ZygadenineKEGG COMPOUND
Manual XrefsDatabases
C00002272KNApSAcK
C10831KEGG COMPOUND
Registry NumbersSources
CAS:545-45-9KEGG COMPOUND