Np mrd loader

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Record Information
Version1.0
Created at2024-04-20 01:32:20 UTC
Updated at2024-04-29 22:18:54 UTC
NP-MRD IDNP0332789
Secondary Accession NumbersNone
Natural Product Identification
Common Namemethoxy-akanthomycin (5)
DescriptionNot Available
Structure
Thumb
SynonymsNot Available
Chemical FormulaC17H27NO4
Average Mass309.4060 Da
Monoisotopic Mass309.19401 Da
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILES
CON1C=CC(O)=C([C@@H]2[C@@H](C)C[C@@H](C)C[C@](C)(O)[C@H]2C)C1=O
InChI Identifier
InChI=1S/C17H27NO4/c1-10-8-11(2)14(12(3)17(4,21)9-10)15-13(19)6-7-18(22-5)16(15)20/h6-7,10-12,14,19,21H,8-9H2,1-5H3/t10-,11+,12+,14-,17+/m1/s1
InChI KeyDAKLRKNVLARTNR-WHOOJLRASA-N
Experimental Spectra
Spectrum TypeDescriptionDepositor EmailDepositor OrganizationDepositorDeposition DateView
1D NMR13C NMR Spectrum (1D, 101 MHz, CD3OD, experimental)peramunu.g.peramuna-1@ou.eduUniversity of OklahomaThilini Peramuna2024-04-20View Spectrum
1D NMR1H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)peramunu.g.peramuna-1@ou.eduUniversity of OklahomaThilini Peramuna2024-04-20View Spectrum
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of OriginNot Available
Chemical Taxonomy
ClassificationNot classified
Physical Properties
StateNot Available
Experimental Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Predicted Properties
PropertyValueSource
External LinksNot Available
References
General ReferencesNot Available