Summary

IMPPAT Phytochemical identifier: IMPHY013301

Phytochemical name: Phytochelatin

Synonymous chemical names:
phytochelatin

External chemical identifiers:
CID:20756463

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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-1

InChIKey:
RWSXRVCMGQZWBV-UHFFFAOYSA-M

DeepSMILES:
SCCC=O)NCC=O)[O-])))))NC=O)CCCC=O)[O-]))[NH3+]

Functional groups:
CC(=O)[O-], CNC(C)=O, CS, C[NH3+]

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Amino acids, peptides, and analogues

NP Classifier Biosynthetic pathway: Amino acids and Peptides

NP Classifier Superclass: Small peptides

NP Classifier Class: Tripeptides

NP-Likeness score: -0.145

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Chemical structure download