Np mrd loader

Record Information
Version2.0
Created at2026-02-06 06:45:21 UTC
Updated at2026-02-20 03:35:04 UTC
NP-MRD IDNP0352290
Natural Product DOIhttps://doi.org/10.57994/5512
Secondary Accession NumbersNone
Natural Product Identification
Common Namepemacromycin A
DescriptionNot Available
Structure
Thumb
SynonymsNot Available
Chemical FormulaC33H54O12
Average Mass642.7830 Da
Monoisotopic Mass642.36153 Da
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILES
CCCC[C@@H]1[C@@H](O)C[C@@H](O)C[C@@H](O)C[C@@H](O)C[C@@H](O)C[C@H]2O[C@](C)(\C=C\C=C\C=C\C=C\[C@@H](O)[C@H](O)[C@@H](C)OC1=O)[C@@H](O)[C@@H]2O
InChI Identifier
InChI=1S/C33H54O12/c1-4-5-12-25-27(39)18-23(36)16-21(34)15-22(35)17-24(37)19-28-30(41)31(42)33(3,45-28)14-11-9-7-6-8-10-13-26(38)29(40)20(2)44-32(25)43/h6-11,13-14,20-31,34-42H,4-5,12,15-19H2,1-3H3/b8-6+,9-7+,13-10+,14-11+/t20-,21+,22-,23+,24-,25?,26-,27+,28-,29-,30-,31+,33-/m1/s1
InChI KeyFXPPHBZEUFWADF-DHQPULOWSA-N
Experimental Spectra
Spectrum TypeDescriptionDepositor EmailDepositor OrganizationDepositorDeposition DateView
COSY NMR[1H, 1H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 400 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
NOESY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HSQC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR13C NMR Spectrum (1D, 151 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
NOESY NMR[1H, 1H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
NOESY NMR[1H, 1H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HSQC NMR[1H, 13C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR13C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR1H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
NOESY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
HSQC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
1D NMR13C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)xuweifeng_u@163.comGuangxi Normal UniversityWei-Feng Xu2026-02-06View Spectrum
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of Origin
Species NameSourceReference
Streptomyces
      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