Organism

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Organism

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Chemical Name: 1-Hydroxy-2-[2'-(2-hydroxy-2-sulfo-acetyl)-biphenyl-2-yl]-2-oxo-ethanesulfonic acid			Synonyms		AIDS# 007190
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 007190
DISODIUM SALT
C16 H14 O10 S2		MW: 430.41			Links to PubMed by CAS#
H-bond donors: 4	H-bond acceptors: 10	PHIA (Flexible Bonds): 6.13	Calc. LogP (MDL QSAR): -1.15
Company:			Calc. LogP (KowWin): -2.37
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: 4 (Score, out of 4)
Classes: ALDEHYDES

Chemical Name: 1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-1-hydroxy-5,5,8a-trimethyl-, (1alpha,4aalpha,8abeta)-			Synonyms Warburganal		AIDS# 009803
					Links to ChemID Plus by CAS# 62994-47-2
					Links to PubChem by AIDS# 009803
ISOLATED FROM WARBURGIA STUHLMANII AND POLYGONUM HYDROPIPER
C15 H22 O3		MW: 250.34			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 3	PHIA (Flexible Bonds): 3.01	Calc. LogP (MDL QSAR): 2.46
Company:			Calc. LogP (KowWin): 1.79
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 1	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 0	Number of References: 0	Number of References: 1	Lipinski: 4 (Score, out of 4)
Classes: SESQUITERPENOIDS; ALDEHYDES

Chemical Name: 1,2-Naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-5,5,8a-trimethyl-, (1R,4aS,8aS)-			Synonyms Polygodial		AIDS# 009806
					Links to ChemID Plus by CAS# 6754-20-7
					Links to PubChem by AIDS# 009806
ISOLATED FROM WARBURGIA UGANDENSIS AND POLYGONUM HYDROPIPER
C15 H22 O2		MW: 234.34			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 2	PHIA (Flexible Bonds): 3.01	Calc. LogP (MDL QSAR): 3.55
Company:			Calc. LogP (KowWin): 3.29
Anti-HIV Cellular data: 0	Anti-HIV Enzyme data: 0	Lines of Data: 38	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 0	Number of References: 0	Number of References: 2	Lipinski: 4 (Score, out of 4)
Classes: SESQUITERPENOIDS; ALDEHYDES

Chemical Name: 1-Dodecanal			Synonyms Lauryl aldehyde Lauraldehyde n-Dodecanal NSC46128		AIDS# 014094
					Links to ChemID Plus by CAS# 112-54-9
					Links to PubChem by AIDS# 014094

C12 H24 O		MW: 184.32			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 1	PHIA (Flexible Bonds): 11.37	Calc. LogP (MDL QSAR): 5.12
Company:			Calc. LogP (KowWin): 4.75
Lines of Data: 3	Anti-HIV Enzyme data: 0	Lines of Data: 1	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 1	Lipinski: 3 (Score, out of 4)
Classes: NATURAL PRODUCTS; ALDEHYDES; VIRUCIDAL AGENTS

Chemical Name: 1-Octanal			Synonyms Capryl aldehyde Caprylaldehyde NSC1508		AIDS# 014103
					Links to ChemID Plus by CAS# 124-13-0
					Links to PubChem by AIDS# 014103

C8 H16 O		MW: 128.21			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 1	PHIA (Flexible Bonds): 7.39	Calc. LogP (MDL QSAR): 3.1
Company:			Calc. LogP (KowWin): 2.78
Lines of Data: 3	Anti-HIV Enzyme data: 0	Anti-OI data: 0	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: NATURAL PRODUCTS; ALDEHYDES

Chemical Name: Benzaldehyde, 4-hydroxy-			Synonyms p-Hydroxybenzaldehyde		AIDS# 017917
					Links to ChemID Plus by CAS# 123-08-0
					Links to PubChem by AIDS# 017917
ISOLATED FROM THE ROOT BARK OF ZANTHOXYLUM AILANTHOIDES
C7 H6 O2		MW: 122.12			Links to PubMed by CAS#
H-bond donors: 1	H-bond acceptors: 2	PHIA (Flexible Bonds): 1.61	Calc. LogP (MDL QSAR): 1.29
Company:			Calc. LogP (KowWin): 1.23
Lines of Data: 1	Anti-HIV Enzyme data: 0	Lines of Data: 3	TB Min MIC 368.85 uM	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 2	Lipinski: 4 (Score, out of 4)
Classes: ALDEHYDES; NATURAL PRODUCTS, PLANT

Chemical Name: 1-Hydroxy-2-oxo-2-(4-phenethyl-phenyl)-ethanesulfonic acid			Synonyms		AIDS# 042219
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 042219
SODIUM SALT
C16 H16 O5 S		MW: 320.36			Links to PubMed by CAS#
H-bond donors: 2	H-bond acceptors: 5	PHIA (Flexible Bonds): 5.07	Calc. LogP (MDL QSAR): 1.58
Company:			Calc. LogP (KowWin): 0.37
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: 4 (Score, out of 4)
Classes: ALDEHYDES

Chemical Name: Oxo-[2'-(2-oxo-acetyl)-biphenyl-2-yl]-acetaldehyde			Synonyms		AIDS# 051232
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 051232

C16 H10 O4		MW: 266.25			Links to PubMed by CAS#
H-bond donors: 0	H-bond acceptors: 4	PHIA (Flexible Bonds): 3.96	Calc. LogP (MDL QSAR): 1.79
Company:			Calc. LogP (KowWin): 1.67
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: 4 (Score, out of 4)
Classes: ALDEHYDES

Chemical Name: Benzaldehyde, 2,4-dihydroxy-3-[(2Z)-3-hydroxy-1-oxo-3-phenyl-2-propenyl]-6-methoxy-5-methyl-			Synonyms		AIDS# 165359
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 165359

C18 H16 O6		MW: 328.32			Links to PubMed by CAS#
H-bond donors: 3	H-bond acceptors: 6	PHIA (Flexible Bonds): 5.38	Calc. LogP (MDL QSAR): 4.07
Company:			Calc. LogP (KowWin): 4.49
Lines of Data: 1	Anti-HIV Enzyme data: 0	Anti-OI data: 0	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: ALDEHYDES; CHALCONES

Chemical Name: Benzaldehyde, 2,4,6-trihydroxy-3-[(2Z)-3-hydroxy-1-oxo-3-phenyl-2-propenyl]-5-methyl-			Synonyms		AIDS# 165360
					Links to ChemID Plus by CAS#
					Links to PubChem by AIDS# 165360

C17 H14 O6		MW: 314.29			Links to PubMed by CAS#
H-bond donors: 4	H-bond acceptors: 6	PHIA (Flexible Bonds): 4.83	Calc. LogP (MDL QSAR): 4.22
Company:			Calc. LogP (KowWin): 4.7
Lines of Data: 1	Anti-HIV Enzyme data: 0	Anti-OI data: 0	TB Min MIC	TB Min IC50	Links to NIST by AIDS#
Number of References: 1	Number of References: 0	Number of References: 0	Lipinski: 4 (Score, out of 4)
Classes: ALDEHYDES; CHALCONES; PHLOROGLUCINOLS

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