| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:17:38 UTC |
|---|
| Update Date | 2025-03-25 01:00:13 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02241574 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C33H56O10 |
|---|
| Molecular Mass | 612.3873 |
|---|
| SMILES | CC(CO)CCCC(C)C1CCC2C3C(O)CC4CC(OC5OC(C(=O)O)C(O)C(O)C5O)CCC4(C)C3CC(O)C12C |
|---|
| InChI Key | MAJMZQXXYJHYEX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | steroids and steroid derivatives |
|---|
| Subclass | steroidal glycosides |
|---|
| Direct Parent | steroid glucuronide conjugates |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | 12-hydroxysteroids7-hydroxysteroidsacetalsalkyl glycosidesbeta hydroxy acids and derivativesbile acids, alcohols and derivativescarbonyl compoundscarboxylic acidscyclic alcohols and derivativesditerpene glycosidesditerpenoidsfatty acyl glycosides of mono- and disaccharidesfatty alcoholsglucuronic acid derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidssecondary alcohols |
|---|
| Substituents | fatty acylfatty acyl glycoside of mono- or disaccharidecarbonyl group12-hydroxysteroidcarboxylic acidglucuronic acid or derivativesabietane diterpenoido-glucuronidemonosaccharidecarboxylic acid derivativebile acid, alcohol, or derivativespyran carboxylic acidditerpene glycoside1-o-glucuronidealiphatic heteropolycyclic compound26-hydroxysteroidbeta-hydroxy acidsaccharideorganic oxideacetalfatty alcoholoxaneprimary alcoholorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesfatty acyl glycosidehydroxysteroidterpene glycosidehydroxy acidcyclic alcohol7-hydroxysteroidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyransecondary alcoholsteroid-glucuronide-skeletonhydrocarbon derivativediterpenoidorganooxygen compoundalkyl glycoside |
|---|
