(2|A,3|A,5|A,14xi,22r)-2,3,14,20,25-pentahydroxy-6-oxocholest-7-en-22-yl dihydrogen phosphate (CHEM104504)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 16:11:35 UTC | ||||||||
| Update Date | 2026-04-05 16:11:35 UTC | ||||||||
| Accession Number | CHEM104504 | ||||||||
| Identification | |||||||||
| Common Name | (2|A,3|A,5|A,14xi,22r)-2,3,14,20,25-pentahydroxy-6-oxocholest-7-en-22-yl dihydrogen phosphate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C27H45O10P | ||||||||
| Average Molecular Mass | 560.621 g/mol | ||||||||
| Monoisotopic Mass | 560.275 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | (2beta,3beta,5beta,14xi,22R)-2,3,14,20,25-Pentahydroxy-6-oxocholest-7-en-22-yl dihydrogen phosphate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C)(O)CC[C@@H](OP(O)(O)=O)[C@](C)(O)[C@H]1CCC2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C | ||||||||
| InChI Identifier | InChI=1S/C27H45O10P/c1-23(2,31)9-8-22(37-38(34,35)36)26(5,32)21-7-11-27(33)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-33H,6-11,13-14H2,1-5H3,(H2,34,35,36)/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27?/m0/s1 | ||||||||
| InChI Key | VQMWDPXOYFYYKP-UWZSVDBBSA-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 | |||||||||
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| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
