Record Information |
---|
Version | 2.0 |
---|
Created at | 2021-01-05 21:37:48 UTC |
---|
Updated at | 2021-07-15 17:11:01 UTC |
---|
NP-MRD ID | NP0012164 |
---|
Secondary Accession Numbers | None |
---|
Natural Product Identification |
---|
Common Name | (4Z)-annimycin |
---|
Provided By | NPAtlas |
---|
Description | (4Z)-annimycin is found in Streptomyces and Streptomyces calvus. Based on a literature review very few articles have been published on (4Z)-annimycin. |
---|
Structure | [H]OC1=C(N([H])C(=O)C([H])([H])[C@@]([H])(O[H])C(\[H])=C(\[H])C([H])=C([H])C(=C(/[H])\C(\[H])=C(/[H])C([H])([H])C([H])([H])[H])\C([H])([H])[H])C(=O)C([H])([H])C1([H])[H] InChI=1S/C19H25NO4/c1-3-4-5-8-14(2)9-6-7-10-15(21)13-18(24)20-19-16(22)11-12-17(19)23/h4-10,15,21-22H,3,11-13H2,1-2H3,(H,20,24)/b5-4+,9-6-,10-7-,14-8+/t15-/m0/s1 |
---|
Synonyms | Value | Source |
---|
(4Z,8E,10E)-3-Hydroxy-N-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-8-methyltrideca-4,6,8,10-tetraenimidate | Generator |
|
---|
Chemical Formula | C19H25NO4 |
---|
Average Mass | 331.4120 Da |
---|
Monoisotopic Mass | 331.17836 Da |
---|
IUPAC Name | (3R,4Z,8E,10E)-3-hydroxy-N-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-8-methyltrideca-4,6,8,10-tetraenamide |
---|
Traditional Name | (3R,4Z,8E,10E)-3-hydroxy-N-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-8-methyltrideca-4,6,8,10-tetraenamide |
---|
CAS Registry Number | Not Available |
---|
SMILES | CC\C=C\C=C(/C)\C=C\C=C/C(O)CC(=O)NC1=C(O)CCC1=O |
---|
InChI Identifier | InChI=1S/C19H25NO4/c1-3-4-5-8-14(2)9-6-7-10-15(21)13-18(24)20-19-16(22)11-12-17(19)23/h4-10,15,21-22H,3,11-13H2,1-2H3,(H,20,24)/b5-4+,9-6+,10-7-,14-8+ |
---|
InChI Key | NWXCMIPYEHNXHW-VQOMMXTDSA-N |
---|
Experimental Spectra |
---|
|
| Not Available | Predicted Spectra |
---|
|
| Spectrum Type | Description | Depositor ID | Depositor Organization | Depositor | Deposition Date | View |
---|
1D NMR | 13C NMR Spectrum (1D, 25 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 100 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 252 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 50 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 200 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 75 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 101 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 400 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 126 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 500 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 176 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 201 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 226 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum |
| Chemical Shift Submissions |
---|
|
| Not Available | Species |
---|
Species of Origin | |
---|
Chemical Taxonomy |
---|
Classification | Not classified |
---|
Physical Properties |
---|
State | Not Available |
---|
Experimental Properties | Property | Value | Reference |
---|
Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
|
---|
Predicted Properties | |
---|