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Lycoricidine

PropertiesImage
MNX_IDMNXM60716 Image of MNXM60716
referencechebi:6600
formulaC14H13NO6
global charge0
mol weight291.259
InChIKeyYYDLFVZOIDOGSO-KKBFJBPOSA-N
InChIInChI=1S/C14H13NO6/c16-8-1-6-5-2-9-10(21-4-20-9)3-7(5)14(19)15-11(6)13(18)12(8)17/h1-3,8,11-13,16-18H,4H2,(H,15,19)/t8-,11+,12+,13-/m0/s1
SMILESO=C1N[C@@H]2C(=C[C@H](O)[C@@H](O)[C@H]2O)C2=CC3=C(C=C12)OCO3
MNX internals
InChI (mnx)InChI=1/C14H13NO6/c16-8-1-6-5-2-9-10(21-4-20-9)3-7(5)14(19)15-11(6)13(18)12(8)17/h1-3,8,11-13,16-18H,4H2,(H,15,19)/t8-,11+,12+,13-/m0/s1 Image of MNXM60716
SMILES (mnx)[CH:1]1=[C:6]2[C:5]3=[CH:2][C:9]4=[C:10]([CH:3]=[C:7]3[C:14]([OH:19])=[N:15][C@H:11]2[C@H:13]([OH:18])[C@H:12]([OH:17])[C@H:8]1[OH:16])[O:21][CH2:4][O:20]4
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd05438
seedM:cpd05438
CHEBI:6600
chebi:6600
kegg.compound:C08531
keggC:C08531
YYDLFVZOIDOGSO-KKBFJBPOSA-N
Lycoricidine

sabiork.compound:26159
sabiorkM:26159
YYDLFVZOIDOGSO-KKBFJBPOSA-N
alpha-Tetralone
1,2,3,4-Tetrahydronaphthalen-1-one

keggC:M_C08531
seedM:M_cpd05438
secondary/obsolete/fantasy identifier