Np mrd loader

Record Information
Version2.0
Created at2025-12-19 21:55:57 UTC
Updated at2026-01-25 03:35:27 UTC
NP-MRD IDNP0352043
Natural Product DOIhttps://doi.org/10.57994/5118
Secondary Accession NumbersNone
Natural Product Identification
Common NameBistaxascendin D
DescriptionNot Available
Structure
Thumb
SynonymsNot Available
Chemical FormulaC40H56O5
Average Mass616.8830 Da
Monoisotopic Mass616.41277 Da
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILES
[H]C(=O)[C@H]1C(C)(C)CCC[C@]1(C)C1=C(C=C(C(C)C)C(O)=C1)[C@@]1([H])O[C@@H]2[C@H](O1)[C@@]1([H])C(C)(C)CCC[C@]1(C)C1=C2C=C(C(C)C)C(O)=C1
InChI Identifier
InChI=1S/C40H56O5/c1-22(2)24-17-26-28(19-30(24)42)40(10)16-12-14-38(7,8)35(40)34-33(26)44-36(45-34)27-18-25(23(3)4)31(43)20-29(27)39(9)15-11-13-37(5,6)32(39)21-41/h17-23,32-36,42-43H,11-16H2,1-10H3/t32-,33-,34-,35-,36-,39+,40+/m0/s1
InChI KeyMWDFPCUZRNPYPD-YMQYVTQYSA-N
Experimental Spectra
Spectrum TypeDescriptionDepositor EmailDepositor OrganizationDepositorDeposition DateView
HSQC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
1D NMR13C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
1D_DEPT NMR13C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
ROESY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
1D_DEPT NMR13C NMR Spectrum (1D, 151 MHz, CD3OD, experimental)[email protected]Yunnan Minzu UniversityWen-Chao Tu2025-12-19View Spectrum
Predicted Spectra
Not Available
Chemical Shift Submissions
Spectrum TypeDescriptionDepositor EmailDepositor OrganizationDepositorDeposition DateView
1D NMR13C NMR Spectrum (1D, 150.0, CD3OD, simulated)[email protected]South China University of TechnologyWen-Chao Tu2025-12-19View Spectrum
Species
Species of Origin
Species NameSourceReference
Taxodium Taxodium ascendens
      Not 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 References