Np mrd loader

Record Information
Version1.0
Created at2023-01-12 04:13:37 UTC
Updated at2024-05-13 01:16:23 UTC
NP-MRD IDNP0331435
Secondary Accession NumbersNone
Natural Product Identification
Common NameNoonindole D
DescriptionNot Available
Structure
Thumb
SynonymsNot Available
Chemical FormulaC33H44N2O6
Average Mass564.7230 Da
Monoisotopic Mass564.31994 Da
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILES
[H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@]([H])(C(=O)C=C3[C@]1(O)[C@H](C2)OC(=O)[C@H](CC)N(C)C)C(C)(C)O
InChI Identifier
InChI=1S/C33H44N2O6/c1-8-23(35(6)7)29(37)41-26-16-18-15-20-19-11-9-10-12-22(19)34-27(20)32(18,5)31(4)14-13-25-21(33(26,31)39)17-24(36)28(40-25)30(2,3)38/h9-12,17-18,23,25-26,28,34,38-39H,8,13-16H2,1-7H3/t18-,23+,25+,26+,28+,31-,32-,33+/m1/s1
InChI KeyTYACATJVIPYUTO-YRVFGSFHSA-N
Experimental Spectra
Spectrum TypeDescriptionDepositor EmailDepositor OrganizationDepositorDeposition DateView
HSQC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2024-05-11View Spectrum
1D NMR1H NMR Spectrum (1D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2024-05-11View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2024-05-11View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2024-05-11View Spectrum
ROESY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2024-05-11View Spectrum
HSQC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2023-01-12View Spectrum
COSY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2023-01-12View Spectrum
1D NMR[1H, ] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2023-01-12View Spectrum
HMBC NMR[1H, 13C] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2023-01-12View Spectrum
ROESY NMR[1H, 1H] NMR Spectrum (2D, 600 MHz, CD3OD, experimental)uqskanka@uq.edu.auNot AvailableNot Available2023-01-12View Spectrum
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of Origin
Species NameSourceReference
noonimiae
      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
  1. Kankanamge S, Khalil ZG, Bernhardt PV, Capon RJ: Noonindoles A-F: Rare Indole Diterpene Amino Acid Conjugates from a Marine-Derived Fungus, Aspergillus noonimiae CMB-M0339. Mar Drugs. 2022 Nov 7;20(11):698. doi: 10.3390/md20110698. [PubMed:36355021 ]