| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:37:13 UTC |
|---|
| Update Date | 2025-03-25 00:45:28 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02149300 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C34H35N3O6 |
|---|
| Molecular Mass | 581.2526 |
|---|
| SMILES | C=Cc1c2[nH]c(c1C)C=C1N=C3C=c4[nH]c(c(C)c4CCC(=O)O)=CC(=C2)C(C)=C(CCC(=O)O)OC(=O)CCC3=C1C |
|---|
| InChI Key | NPVIOTCETOQNFM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrroles |
|---|
| Subclass | substituted pyrroles |
|---|
| Direct Parent | dipyrrins |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsenol estersheteroaromatic compoundshydrocarbon derivativesketimineslactonesorganic oxidesorganopnictogen compoundsoxacyclic compoundspropargyl-type 1,3-dipolar organic compoundspyrrolestricarboxylic acids and derivatives |
|---|
| Substituents | ketiminecarbonyl groupcarboxylic acidiminetricarboxylic acid or derivativescarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundlactonedipyrrinorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundenol esterazacycleheteroaromatic compoundorganic 1,3-dipolar compoundoxacycleorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
|---|
