[(13s,14s)-13-methyl-17-oxo-12,14,15,16-tetrahydro-11h-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate (CHEM307885)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-29 08:18:33 UTC | ||||||||
| Update Date | 2026-08-29 08:18:33 UTC | ||||||||
| Accession Number | CHEM307885 | ||||||||
| Identification | |||||||||
| Common Name | [(13s,14s)-13-methyl-17-oxo-12,14,15,16-tetrahydro-11h-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C18H18O5S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 346.087 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | [(13s,14s)-13-methyl-17-oxo-12,14,15,16-tetrahydro-11h-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC12CCC3=C(C1CCC2=O)C=CC4=C3C=CC(=C4)OS(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C18H18O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h2-5,10,16H,6-9H2,1H3,(H,20,21,22)/t16-,18-/m0/s1 | ||||||||
| InChI Key | JKOQYKCAHYAMBW-WMZOPIPTSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
