Summary
IMPPAT Phytochemical identifier: IMPPAT3_PHYID006079
Phytochemical name: Phytochelatin
Synonymous chemical names:phytochelatin
External chemical identifiers:CID:CID_20756463
Chemical structure information
SMILES:
SCC(C(=O)NCC(=O)[O-])NC(=O)CCC(C(=O)[O-])[NH3+]InChI:
InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/p-1InChIKey:
RWSXRVCMGQZWBV-UHFFFAOYSA-MDeepSMILES:
SCCC=O)NCC=O)[O-])))))NC=O)CCCC=O)[O-]))[NH3+]Functional groups:
CS, CNC(C)=O, CC(=O)[O-], C[NH3+]
Chemical classification
ClassyFire Kingdom: Organic compoundsClassyFire Superclass: Organic acids and derivativesClassyFire Class: Carboxylic acids and derivatives
ClassyFire Subclass: Amino acids, peptides, and analogues
NP-Likeness score: -0.145
Chemical structure download
