NP-MRD: Showing NP-Card for Antibiotic TAN 749D (NP0061661)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-04-28 06:24:31 UTC

Updated at

2022-04-28 06:24:32 UTC

NP-MRD ID

NP0061661

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Antibiotic TAN 749D

Description

Sperabillin D belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom. Antibiotic TAN 749D is found in Pseudomonas fluorescens and Pseudomonas fluorescens YK-437. Antibiotic TAN 749D was first documented in 2004 (PMID: 15351828). Based on a literature review very few articles have been published on Sperabillin D.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 53 52  0  0  0  0  0  0  0  0999 V2000
   -8.2501   -2.3808   -3.5325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9318   -1.4442   -3.8581 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1867   -0.6420   -3.1952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8286    0.5972   -3.7535 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7087   -1.0235   -1.8512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1984   -1.0236   -1.8895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6100   -1.3818   -0.6393 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2047   -1.4347   -0.4787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4912   -1.1605   -1.4555 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6402   -1.8088    0.8264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1488   -1.6573    0.9475 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.7455   -2.3304    2.1428 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7241   -0.2573    0.7716 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6925    0.1145    0.7012 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6377    1.5663    0.5261 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6554   -0.1328    1.7706 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0634   -1.5149    2.1203 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9450    0.5171    1.3521 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5181    1.5661    2.0871 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9105    1.9631    3.1376 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7425    2.1912    1.6976 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4405    1.8538    0.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6792    2.5901    0.3661 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3790    2.2562   -0.6948 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6378    2.9905   -0.9841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9569    0.6992   -4.3055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4329    1.4279   -3.6207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0613   -0.2792   -1.0973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1027   -2.0278   -1.5611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8856    0.0116   -2.1896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9038   -1.7050   -2.7203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2176   -1.6083    0.1687 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1390   -1.2463    1.6501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8351   -2.9121    0.9715 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7393   -2.3169    0.1015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4666   -3.3325    2.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3704   -2.2043    2.9518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3121    0.4393    1.4789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1741    0.0892   -0.2138 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1014   -0.2130   -0.2837 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1399    1.8314    1.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3686    0.4022    2.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2068   -1.6075    2.1964 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8370   -2.2601    1.3336 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7343   -1.9140    3.0834 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4202    0.1792    0.4996 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1191    3.0016    2.3273 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1123    1.0685   -0.0112 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0187    3.3905    1.0192 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0264    1.4519   -1.3396 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7516    3.1354   -2.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5139    2.3899   -0.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6147    3.9763   -0.4798 H   0  0  0  0  0  0  0  0  0  0  0  0
 25 24  1  0
 24 23  2  0
 23 22  1  0
 22 21  2  0
 21 19  1  0
 19 20  2  0
 19 18  1  0
 18 16  1  0
 16 17  1  0
 16 14  1  0
 14 15  1  0
 14 13  1  0
 13 11  1  0
 11 12  1  0
 11 10  1  0
 10  8  1  0
  8  9  2  0
  8  7  1  0
  7  6  1  0
  6  5  1  0
  5  3  1  0
  3  4  1  0
  3  2  2  0
 25 51  1  0
 25 52  1  0
 25 53  1  0
 24 50  1  0
 23 49  1  0
 22 48  1  0
 21 47  1  0
 18 46  1  0
 16 42  1  1
 17 43  1  0
 17 44  1  0
 17 45  1  0
 14 40  1  6
 15 41  1  0
 13 38  1  0
 13 39  1  0
 11 35  1  6
 12 36  1  0
 12 37  1  0
 10 33  1  0
 10 34  1  0
  7 32  1  0
  6 30  1  0
  6 31  1  0
  5 28  1  0
  5 29  1  0
  4 26  1  0
  4 27  1  0
  2  1  1  0
M  END


  Mrv1652304282208242D          

 24 23  0  0  1  0            999 V2000
    4.7586    3.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4730    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4730    4.8099    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1875    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9020    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6164    3.5724    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3309    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3309    4.8099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0454    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7599    3.9849    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.4743    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1888    3.9849    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.9033    3.5724    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9033    2.7474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6177    3.9849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3322    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3322    2.7474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0467    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7612    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4756    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1901    3.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9046    3.9849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1888    4.8099    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7599    4.8099    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  6  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 12 23  1  1  0  0  0
 10 24  1  6  0  0  0
M  END
> <DATABASE_ID>
NP0061661

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C\C=C\C=C\C(=O)N[C@H](C)[C@H](O)C[C@@H](N)CC(=O)NCCC(N)=N

> <INCHI_IDENTIFIER>
InChI=1S/C16H29N5O3/c1-3-4-5-6-15(23)21-11(2)13(22)9-12(17)10-16(24)20-8-7-14(18)19/h3-6,11-13,22H,7-10,17H2,1-2H3,(H3,18,19)(H,20,24)(H,21,23)/b4-3+,6-5+/t11-,12-,13-/m1/s1

> <INCHI_KEY>
HGBIYXQMCATWPJ-PXRNKZPESA-N

> <FORMULA>
C16H29N5O3

> <MOLECULAR_WEIGHT>
339.44

> <EXACT_MASS>
339.227039814

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
53

> <JCHEM_AVERAGE_POLARIZABILITY>
38.297711986053336

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(3R,5R,6R)-3-amino-N-(2-carbamimidoylethyl)-6-[(2E,4E)-hexa-2,4-dienamido]-5-hydroxyheptanamide

> <ALOGPS_LOGP>
-0.36

> <JCHEM_LOGP>
-2.053537863426339

> <ALOGPS_LOGS>
-3.45

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA>
15.639146864595098

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.501164564825618

> <JCHEM_PKA_STRONGEST_BASIC>
12.55767805513672

> <JCHEM_POLAR_SURFACE_AREA>
154.32

> <JCHEM_REFRACTIVITY>
105.5723

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.20e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(3R,5R,6R)-3-amino-N-(2-carbamimidoylethyl)-6-[(2E,4E)-hexa-2,4-dienamido]-5-hydroxyheptanamide

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 28-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   28-APR-22         0                                  
HETATM    1  N   UNK     0       8.883   6.668   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0      10.216   7.438   0.000  0.00  0.00           C+0
HETATM    3  N   UNK     0      10.216   8.978   0.000  0.00  0.00           N+0
HETATM    4  C   UNK     0      11.550   6.668   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      12.884   7.438   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0      14.217   6.668   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0      15.551   7.438   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      15.551   8.978   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      16.885   6.668   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      18.218   7.438   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      19.552   6.668   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      20.886   7.438   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      22.219   6.668   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      22.219   5.128   0.000  0.00  0.00           C+0
HETATM   15  N   UNK     0      23.553   7.438   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0      24.887   6.668   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      24.887   5.128   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      26.220   7.438   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      27.554   6.668   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      28.888   7.438   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      30.222   6.668   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      31.555   7.438   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      20.886   8.978   0.000  0.00  0.00           O+0
HETATM   24  N   UNK     0      18.218   8.978   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11   24                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   23                                                  
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21                                                            
CONECT   23   12                                                            
CONECT   24   10                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   46    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₆H₂₉N₅O₃

Average Mass

339.4400 Da

Monoisotopic Mass

339.22704 Da

IUPAC Name

(3R,5R,6R)-3-amino-N-(2-carbamimidoylethyl)-6-[(2E,4E)-hexa-2,4-dienamido]-5-hydroxyheptanamide

Traditional Name

(3R,5R,6R)-3-amino-N-(2-carbamimidoylethyl)-6-[(2E,4E)-hexa-2,4-dienamido]-5-hydroxyheptanamide

CAS Registry Number

Not Available

SMILES

C\C=C\C=C\C(=O)N[C@H](C)[C@H](O)C[C@@H](N)CC(=O)NCCC(N)=N

InChI Identifier

InChI=1S/C16H29N5O3/c1-3-4-5-6-15(23)21-11(2)13(22)9-12(17)10-16(24)20-8-7-14(18)19/h3-6,11-13,22H,7-10,17H2,1-2H3,(H3,18,19)(H,20,24)(H,21,23)/b4-3+,6-5+/t11-,12-,13-/m1/s1

InChI Key

HGBIYXQMCATWPJ-PXRNKZPESA-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

Species Name	Source	Reference
Pseudomonas fluorescens	LOTUS Database	35616633
Pseudomonas fluorescens YK-437	Bacteria	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Substituents

Beta amino acid or derivatives
Fatty amide
N-acyl-amine
Fatty acyl
1,3-aminoalcohol
Secondary carboxylic acid amide
Secondary alcohol
Carboxamide group
Amidine
Carboximidamide
Carboxylic acid amidine
Organic oxygen compound
Alcohol
Primary aliphatic amine
Organonitrogen compound
Organooxygen compound
Primary amine
Carbonyl group
Organic nitrogen compound
Amine
Hydrocarbon derivative
Organic oxide
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

Not Available

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

Property	Value	Source
logP	-0.36	ALOGPS
logP	-2.1	ChemAxon
logS	-3.4	ALOGPS
pKa (Strongest Acidic)	14.5	ChemAxon
pKa (Strongest Basic)	12.56	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	6	ChemAxon
Polar Surface Area	154.32 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	105.57 m³·mol⁻¹	ChemAxon
Polarizability	38.3 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00017216

Chemspider ID

4948078

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

6444141

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Davies SG, Haggitt JR, Ichihara O, Kelly RJ, Leech MA, Price Mortimer AJ, Roberts PM, Smith AD: Asymmetric total synthesis of sperabillins B and D via lithium amide conjugate addition. Org Biomol Chem. 2004 Sep 21;2(18):2630-49. doi: 10.1039/B404962D. Epub 2004 Aug 24. [PubMed:15351828 ]

Showing NP-Card for Antibiotic TAN 749D (NP0061661)

MOL for NP0061661 (Antibiotic TAN 749D)

3D MOL for NP0061661 (Antibiotic TAN 749D)

3D SDF for NP0061661 (Antibiotic TAN 749D)

3D-SDF for NP0061661 (Antibiotic TAN 749D)

PDB for NP0061661 (Antibiotic TAN 749D)

3D PDB for NP0061661 (Antibiotic TAN 749D)

SMILES for NP0061661 (Antibiotic TAN 749D)

INCHI for NP0061661 (Antibiotic TAN 749D)

Structure for NP0061661 (Antibiotic TAN 749D)

3D Structure for NP0061661 (Antibiotic TAN 749D)