Browse Metabolites / Manihot esculenta
A total of 861 metabolites have been identified from Manihot esculenta. The detail information about materials and analytical conditions can be found in metadata.
ID
molecular formula
molecular weight
SMILES
Database
Mid000008
C6H11NO
113.16
C1CCC(=O)NCC1
kegg_C06593;CID_7768;knapsack_C00000318
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
Mid000025
C9H7N
129.16
C1=CC=C2C(=C1)C=CC=N2
kegg_C06413;knapsack_C00026478
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
Mid000028
C9H9N
131.17
CC1=CC2=C(C=C1)C=CN2
knapsack_C00050748
ID
molecular formula
molecular weight
SMILES
Database
Mid000034
C9H10O
134.17
C1CC2=CC=CC=C2C1O
kegg_C01710;CID_22819
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;
ID
molecular formula
molecular weight
SMILES
Database
Mid000039
C8H8O2
136.15
CC1=CC(=CC(=C1)O)C=O
CID_12293123