Methyl 2,3-didehydroaspidospermidine-3-carboxylate (CHEM114195)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 01:19:19 UTC | ||||||||
| Update Date | 2026-05-21 00:32:40 UTC | ||||||||
| Accession Number | CHEM114195 | ||||||||
| Identification | |||||||||
| Common Name | Methyl 2,3-didehydroaspidospermidine-3-carboxylate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type |
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| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C21H26N2O2 | ||||||||
| Average Molecular Mass | 338.451 g/mol | ||||||||
| Monoisotopic Mass | 338.199 g/mol | ||||||||
| CAS Registry Number | 07-10-47 | ||||||||
| IUPAC Name | Methyl 5alpha,12beta,19alpha-2,3-didehydroaspidospermidine-3-carboxylate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | [H][C@@]12N3CC[C@]11C(NC4=CC=CC=C14)=C(C[C@]2(CC)CCC3)C(=O)OC | ||||||||
| InChI Identifier | InChI=1S/C21H26N2O2/c1-3-20-9-6-11-23-12-10-21(19(20)23)15-7-4-5-8-16(15)22-17(21)14(13-20)18(24)25-2/h4-5,7-8,19,22H,3,6,9-13H2,1-2H3/t19-,20-,21-/m0/s1 | ||||||||
| InChI Key | GIGFIWJRTMBSRP-ACRUOGEOSA-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 | ||||||||
