Browse Metabolites / Dioscorea esculenta
A total of 598 metabolites have been identified from Dioscorea esculenta. The detail information about materials and analytical conditions can be found in metadata.
ID
molecular formula
molecular weight
SMILES
Database
Mid000001
C5H13NO
104.17
C[N+](C)(C)CCO
CAS:62-49-7;KEGG:C00114;
ID
molecular formula
molecular weight
SMILES
Database
Mid000010
C8H7N
117.15
C1=CC=C2C(=C1)C=CN2
kegg_C00463;CID_798;knapsack_C00001418
ID
molecular formula
molecular weight
SMILES
Database
Mid000013
C9H10
118.18
CC(=C)C1=CC=CC=C1
kegg_C14395
ID
molecular formula
molecular weight
SMILES
Database
Mid000017
C6H6N2O
122.12
C1=CC(=CN=C1)C(=O)N
CAS:98-92-0
ID
molecular formula
molecular weight
SMILES
Database
Mid000026
C6H11NO2
129.16
C1CCNC(C1)C(=O)O
CID_736316
ID
molecular formula
molecular weight
SMILES
Database
Mid000027
C8H19N
129.24
CCCCCCCCN
kegg_C01740;CID_8143
ID
molecular formula
molecular weight
SMILES
Database
Mid000029
C6H13NO2
131.17
CCC(C)C(C(=O)O)N
kegg:NA
ID
molecular formula
molecular weight
SMILES
Database
Mid000031
C9H8O
132.16
C1C(=O)CC2=CC=CC=C21
kegg_C07727;CID_11983
ID
molecular formula
molecular weight
SMILES
Database
Mid000036
C10H14
134.22
CC1=CC=CC=C1C(C)C
knapsack_C00010974
ID
molecular formula
molecular weight
SMILES
Database
Mid000037
C5H5N5
135.13
C1=NC2=NC=NC(=C2N1)N
CAS:73-24-5;KEGG:C00147;