Browse Metabolites / parsley (Petroselinum crispum)
A total of 383 metabolites have been identified from parsley (Petroselinum crispum)
ID
molecular formula
molecular weight
SMILES
Met003200
C29H32O16
636.6
CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC(=C(C=C4)OC)O)O)OC5C(C(CO5)(CO)O)O)O)O
ID
molecular formula
molecular weight
SMILES
Met006630
C7H8O7
204.13
C1=C(OC(C(C1O)O)C(=O)O)C(=O)O
ID
molecular formula
molecular weight
SMILES
Met008115
C27H31O16+
611.5
C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O
ID
molecular formula
molecular weight
SMILES
Met002224
C23H18O7
406.4
CC1=C(C(=O)C(=CO1)C2=C(C=C3C(=C2O)C(=O)C=C(O3)C4=CC=CC=C4)OC)OC
ID
molecular formula
molecular weight
SMILES
Met008161
C40H38N4O16
830.7
C1=C2C(=C(C(=CC3=NC(=CC4=NC(=CC5=C(C(=C1N5)CCC(=O)O)CC(=O)O)C(=C4CC(=O)O)CCC(=O)O)C(=C3CCC(=O)O)CC(=O)O)N2)CC(=O)O)CCC(=O)O
ID
molecular formula
molecular weight
SMILES
Met007189
C37H58O5
582.9
CCCCCCCCC=CCCCCCCCC(=O)OCC1=CC(=C(C(=C1C=O)O)CC=C(C)CCC=C(C)C)OC
ID
molecular formula
molecular weight
SMILES
Met004613
C17H20O9
368.3
COC1=C(C=CC(=C1)C=CC(=O)OC2CC(CC(C2O)O)(C(=O)O)O)O
ID
molecular formula
molecular weight
SMILES
Met003117
C28H29F2N3O
461.5
C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F
ID
molecular formula
molecular weight
SMILES
Met009724
C35H46O16
722.7
CC1C(=O)OC2C1(C(C3C(C(C=CC(=C2)COC(=O)C)OC(=O)C)(C(C(C(C34CO4)OC(=O)C)OC(=O)CC(C)C)OC(=O)C)C)OC(=O)C)O
ID
molecular formula
molecular weight
SMILES
Met004324
C30H33O16+
649.6
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=[OH+])C=C5C4=C3C=C(O5)C)C6=CC(=C(C(=C6)O)O)O)O)O)O)O)O)O