| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:11 UTC |
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| Update Date | 2025-03-25 00:55:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213360 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H28N4O2S |
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| Molecular Mass | 328.1933 |
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| SMILES | CN(C)Cc1ccc(CSCCNC(=NCCO)N(C)C)o1 |
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| InChI Key | UBPNIAPYPHTKLL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | aralkylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alcohols and polyolsalkanolaminescarboximidamidesdialkylthioethersfuransguanidinesheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundspropargyl-type 1,3-dipolar organic compoundssulfenyl compoundstrialkylamines |
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| Substituents | furanaromatic heteromonocyclic compoundguanidineorganosulfur compoundaralkylaminepropargyl-type 1,3-dipolar organic compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundalkanolaminealcoholsulfenyl compounddialkylthioetherheteroaromatic compoundtertiary aliphatic amineorganic 1,3-dipolar compoundcarboximidamideoxacycleorganic oxygen compoundthioetherhydrocarbon derivativeorganooxygen compound |
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