DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 08:51:36 UTC
Update Date	2025-03-25 00:26:47 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID01327108
Frequency	1.0
Structure
Chemical Formula	C₃₇H₆₁N₁₃O₁₁S₂
Molecular Mass	927.4055
SMILES	CC(C)CC1NC(=O)C(N)CSSCC(C(=O)N2CCCC2C(=O)NC(CCCNC(=N)N)C(=O)O)NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC(=O)C2CCCN2C1=O
InChI Key	FOAXKWXIHDBDMR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic polymers
Class	polypeptides
Subclass	polypeptides
Direct Parent	polypeptides
Geometric Descriptor	aliphatic heteropolycyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids arginine and derivatives azacyclic compounds branched fatty acids carbonyl compounds carboximidamides carboxylic acids cyclic peptides fatty amides guanidines heterocyclic fatty acids hydrocarbon derivatives imines lactams monoalkylamines monocarboxylic acids and derivatives n-acyl-alpha amino acids n-acylpyrrolidines organic disulfides organic oxides organopnictogen compounds primary carboxylic acid amides proline and derivatives pyrrolidinecarboxamides secondary carboxylic acid amides tertiary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl carbonyl group lactam carboxylic acid heterocyclic fatty acid guanidine imine fatty amide n-acylpyrrolidine fatty acid alpha-amino acid or derivatives carboxylic acid derivative aliphatic heteropolycyclic compound organic oxide arginine or derivatives tertiary carboxylic acid amide organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives polypeptide alpha-amino acid amide azacycle n-acyl-alpha-amino acid carboximidamide carboxamide group branched fatty acid secondary carboxylic acid amide monocarboxylic acid or derivatives pyrrolidine carboxylic acid or derivatives organic oxygen compound cyclic alpha peptide organic disulfide hydrocarbon derivative primary aliphatic amine organic nitrogen compound pyrrolidine-2-carboxamide organooxygen compound

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