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Chemical Name: .alpha.-D-Glucopyranose, 1,16-anhydro-1-C-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-4-O-[6-O-(8-hydroxy-1-oxo-2,4,6-decatrienyl)-.beta.-D-galactopyranosyl]-, 3-(7-hydroxy-8,14-dimethyl-2,4,8,10-hexadecatetraenoate) Synonyms

  • Papulacandin B
  • A-32283-B
AIDS# 008605
Click For Structure Based Search Links to ChemID Plus by CAS#

61032-80-2

Links to PubChem by AIDS#

008605


ISOLATED FROM PAPULARIA SPHAEROSPERMA 
C47 H64 O17  MW: 901.01 Links to PubMed by CAS#

H-bond donors: 9 H-bond acceptors: 17 PHIA (Flexible Bonds): 21.21 Calc. LogP
(MDL QSAR): 1.42
Company:  Calc. LogP
(KowWin): 6.65
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 10
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 4
Lipinski:    1                     (Score, out of 4)
Classes: C-GLYCOSIDES; NATURAL PRODUCTS; .BETA.-GLUCAN SYNTHASE INHIBITORS

 

Chemical Name: Hexopyranoside, 3',4',5',6'-tetrahydro-3',5,7-trihydroxy-6'-(hydroxymethyl)-4'-[(7-hydroxy-1-oxo-2,4,8,10,12-hexadecapentaenyl)oxy]spiro[isobenzofuran-1(3H),2'-[2H]pyran]-5'-yl,6-(2,4,6-decatrienoate) Synonyms

  • BU-4794F
AIDS# 027919
Click For Structure Based Search Links to ChemID Plus by CAS#

151013-36-4

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027919


ISOLATED FROM GILMANIELLA SP. FA4459 
C45 H58 O16  MW: 854.94 Links to PubMed by CAS#

H-bond donors: 8 H-bond acceptors: 16 PHIA (Flexible Bonds): 20.43 Calc. LogP
(MDL QSAR): 1.13
Company:  BRISTOL-MYERS SQUIBB Calc. LogP
(KowWin): 7.01
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 7
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: NATURAL PRODUCTS; .BETA.-GLUCAN SYNTHASE INHIBITORS

 

Chemical Name: Papulacandin M Synonyms

  • Papulacandin M
  • BU-4785F
  • WF3010
AIDS# 027920
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027920


ISOLATED FROM PAPULARIA SPHAEROSPERMA; STRUCTURE NOT AVAILABLE 
  MW: 0 Links to PubMed by CAS#

H-bond donors: H-bond acceptors: PHIA (Flexible Bonds): Calc. LogP
(MDL QSAR):
Company:  MERCIAN; BRISTOL-MYERS SQUIBB Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 6
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:                         (Score, out of 4)
Classes: NATURAL PRODUCTS; .BETA.-GLUCAN SYNTHASE INHIBITORS

 

Chemical Name: D-alloThr-L-D-Ala-Tyr-L-Val-Trans-4OH-L-Pro-D-allo Thr-L-Thr-Trans-3OH-L-Pro-Threo-3OH-L-Gln-D-allo Thr-L-Orn Synonyms

  • FR901469
  • FR-901469
AIDS# 096758
Click For Structure Based Search Links to ChemID Plus by CAS#

174778-71-3

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096758


ISOLATED FROM UNIDENTIFIED FUNGUS NO.11243; HYDROCHLORIDE 
C71 H116 N14 O23  MW: 1533.77 Links to PubMed by CAS#

H-bond donors: 20 H-bond acceptors: 37 PHIA (Flexible Bonds): 41.05 Calc. LogP
(MDL QSAR): -0.47
Company:  FUJISAWA PHARM Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 2
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109733
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109733


 
C80 H136 N18 O24  MW: 1734.06 Links to PubMed by CAS#

H-bond donors: 23 H-bond acceptors: 42 PHIA (Flexible Bonds): 49.02 Calc. LogP
(MDL QSAR): -1.09
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 3
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109734
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Links to PubChem by AIDS#

109734


 
C80 H136 N18 O24  MW: 1734.06 Links to PubMed by CAS#

H-bond donors: 23 H-bond acceptors: 42 PHIA (Flexible Bonds): 49.02 Calc. LogP
(MDL QSAR): -1.09
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109735
Click For Structure Based Search Links to ChemID Plus by CAS#

Links to PubChem by AIDS#

109735


 
C79 H133 N17 O24  MW: 1705.01 Links to PubMed by CAS#

H-bond donors: 22 H-bond acceptors: 41 PHIA (Flexible Bonds): 47.58 Calc. LogP
(MDL QSAR): -1.07
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 3
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109736
Click For Structure Based Search Links to ChemID Plus by CAS#

Links to PubChem by AIDS#

109736


 
C79 H133 N17 O24  MW: 1705.01 Links to PubMed by CAS#

H-bond donors: 22 H-bond acceptors: 41 PHIA (Flexible Bonds): 47.58 Calc. LogP
(MDL QSAR): -1.07
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 3
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109737
Click For Structure Based Search Links to ChemID Plus by CAS#

Links to PubChem by AIDS#

109737


 
C83 H143 N19 O24  MW: 1791.15 Links to PubMed by CAS#

H-bond donors: 23 H-bond acceptors: 43 PHIA (Flexible Bonds): 51.35 Calc. LogP
(MDL QSAR): -1.58
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

Chemical Name: Synonyms
AIDS# 109738
Click For Structure Based Search Links to ChemID Plus by CAS#

Links to PubChem by AIDS#

109738


 
C83 H143 N19 O24  MW: 1791.15 Links to PubMed by CAS#

H-bond donors: 23 H-bond acceptors: 43 PHIA (Flexible Bonds): 51.35 Calc. LogP
(MDL QSAR): -1.58
Company:  NIPPON ROCHE Calc. LogP
(KowWin): 
Anti-HIV Cellular data: 0
Anti-HIV Enzyme data: 0

Lines of Data: 4
TB Min MIC

   
TB Min IC50

   
Links to NIST by AIDS#

Number of References: 0
Number of References: 0

Number of References: 1
Lipinski:    1                     (Score, out of 4)
Classes: ANTIFUNGALS; .BETA.-GLUCAN SYNTHASE INHIBITORS; PEPTIDES, CYCLIC; ANTIBIOTICS, PEPTIDE

 

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