NP-MRD: Search Results for natural products

Searching natural products for "acetic acid" AND biofluid_source:urine returned 91557 results.
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NP0081017

Calcigeroside C1

Chemical Formula: C₅₄H₈₄O₂₈S
Average Mass: 1213.3000 Da
Monoisotopic Mass: 1212.48698 Da

Matched synonyms: … (prop-1-en-2-yl)-17-oxapentacyclo[14.2.1.0,.0,.0,]nonadec-12-en-8-yl]oxy}oxan-3-yl]oxidanesulphonic acid …
Matched iupac: … 17-oxapentacyclo[14.2.1.0^{1,14}.0^{4,13}.0^{5,10}]nonadec-12-en-8-yl]oxy}oxan-3-yl]oxidanesulfonic acid …

NP0081318

Achlioniceoside A3

Chemical Formula: C₆₀H₉₄O₃₄S₂
Average Mass: 1423.5000 Da
Monoisotopic Mass: 1422.50679 Da

Matched synonyms: … oxapentacyclo[10.8.0.0,.0,.0,]icos-11-en-16-yl]oxy}oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}sulphonic acid …
Matched iupac: … )methyl]oxan-2-yl]oxy}oxan-3-yl]oxy}-2-methyloxan-3-yl]oxy}-3,5-dihydroxyoxan-2-yl]methoxy}sulfonic acid …

NP0003961

Memnopeptide A

Chemical Formula: C₇₆H₁₀₈N₁₆O₁₈S
Average Mass: 1565.8500 Da
Monoisotopic Mass: 1564.77482 Da

Matched synonyms: … -2-yl](hydroxy)methylidene}amino)-4-methylpentanoyl]pyrrolidine-2-carbonyl}pyrrolidine-2-carboxylic acid …
Matched iupac: … carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid …

NP0021340

Esperamicin A1

Chemical Formula: C₅₉H₈₀N₄O₂₂S₄
Average Mass: 1325.5400 Da
Monoisotopic Mass: 1324.41470 Da

Matched synonyms: … dien-3,7-diyn-10-yl]oxy}-2-methyloxan-4-yl]oxy}carbonyl)-4,5-dimethoxyphenyl]-2-methoxyprop-2-enimidic acid …

NP0021352

Bleomycin demethyl A2

Chemical Formula: C₅₄H₈₁N₁₇O₂₁S₃
Average Mass: 1400.5200 Da
Monoisotopic Mass: 1399.49551 Da

Matched synonyms: … dihydroxybutylidene]amino}ethyl)-1,3-thiazol-4-yl]-N-[3-(methylsulphanyl)propyl]-1,3-thiazole-4-carboximidic acid …

NP0080086

Solasteroside A

Chemical Formula: C₅₆H₉₂O₂₆S
Average Mass: 1213.3900 Da
Monoisotopic Mass: 1212.55975 Da

Matched synonyms: … 6-methylhept-5-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-1(17)-en-5-yl]oxidanesulphonic acid …
Matched iupac: … methylhept-5-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(17)-en-5-yl]oxidanesulfonic acid …

NP0004598

Enterolysin A

Chemical Formula: C₇₅H₁₃₇N₁₇O₁₉S
Average Mass: 1613.0800 Da
Monoisotopic Mass: 1611.99974 Da

Matched synonyms: … methylpentylidene]amino}-1,3-dihydroxypropylidene]amino}-1-hydroxy-3-methylpentylidene]amino}-3-methylbutanoic acid …
Matched iupac: … -methylbutanamido]-4-methylpentanamido]-3-hydroxypropanamido]-3-methylpentanamido]-3-methylbutanoic acid …

NP0006556

Michiganin A

Chemical Formula: C₉₂H₁₄₅N₂₅O₂₆S₄
Average Mass: 2145.5600 Da
Monoisotopic Mass: 2143.96754 Da

Matched synonyms: … nonatriaconta-2,5,8,11,14,22,25,32,35,38-decaen-27-yl](hydroxy)methylidene}amino)-5-carbamimidamidopentanoic acid …
Matched iupac: … 2,5,8,11,14,23,26,33,36,39-decaazabicyclo[19.10.8]nonatriacontan-27-yl]formamido}-5-carbamimidamidopentanoic acid …

NP0023886

Enterocin EJ97

Chemical Formula: C₈₈H₁₄₄N₂₀O₁₈S₂
Average Mass: 1834.3600 Da
Monoisotopic Mass: 1833.04089 Da

Matched synonyms: … C-hydroxycarbonimidoyl)-1-oxopropan-2-yl]-C-hydroxycarbonimidoyl}pyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-yl]hexanimidic acid …

NP0080063

(+)-Psilasteroside

Chemical Formula: C₆₁H₁₀₀O₃₂S
Average Mass: 1377.5000 Da
Monoisotopic Mass: 1376.59184 Da

Matched synonyms: … methyl-4-oxohexan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-1(17)-en-5-yl]methoxy}sulphonic acid …
Matched iupac: … oxohexan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(17)-en-5-yl]methoxy}sulfonic acid …

NP0022595

Linocin M18

Chemical Formula: C₉₁H₁₄₆N₂₄O₂₇S
Average Mass: 2040.3700 Da
Monoisotopic Mass: 2039.05100 Da

Matched synonyms: … pyrrolidin-1-yl]-1-oxopropan-2-yl}-C-hydroxycarbonimidoyl)-3-methylbutyl]-C-hydroxycarbonimidoyl}butanoic acid …
Matched iupac: … -methylpentanamido]propanoyl]pyrrolidin-2-yl]formamido}-3-methylpentanoyl]pyrrolidin-2-yl]formamido}acetyl ... pyrrolidin-2-yl]formamido}propanamido]propanamido]propanamido]-4-carboxybutanamido]-3-methylpentanoic acid …

NP0045870

137181-56-7

Systemin

Chemical Formula: C₈₅H₁₄₄N₂₆O₂₈S
Average Mass: 2010.2750 Da
Monoisotopic Mass: 2009.03641 Da

Matched synonyms: … -1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}-1,3-dihydroxybutylidene]amino}-4-oxobutanoic acid …
Matched iupac: … -2,6-diaminohexanamido]-4-(methylsulfanyl)butanamido]butanamido]-3-hydroxybutanamido]-4-oxobutanoic acid …

NP0080183

Anasteroside A

Chemical Formula: C₆₂H₁₀₂O₃₂S
Average Mass: 1391.5300 Da
Monoisotopic Mass: 1390.60749 Da

Matched synonyms: … dimethyl-14-[(2R)-6-methyl-4-oxoheptan-2-yl]tetracyclo[8.7.0.0,.0,]heptadec-1(17)-en-5-yl]oxidanesulphonic acid …
Matched iupac: … 6-methyl-4-oxoheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(17)-en-5-yl]oxidanesulfonic acid …

NP0006983

Salivaricin P

Chemical Formula: C₈₅H₁₂₉N₂₉O₂₄S
Average Mass: 1973.2100 Da
Monoisotopic Mass: 1971.94860 Da

Matched synonyms: … ethyl]-C-hydroxycarbonimidoyl}methyl)-2-{[(2S)-2,6-diamino-1-hydroxyhexylidene]amino}butanediimidic acid …

NP0080318

Versicoside A

Chemical Formula: C₆₂H₁₀₂O₃₃S
Average Mass: 1407.5300 Da
Monoisotopic Mass: 1406.60241 Da

Matched synonyms: … methyl-4-oxoheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-1(17)-en-5-yl]oxidanesulphonic acid …
Matched iupac: … oxoheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(17)-en-5-yl]oxidanesulfonic acid …

NP0001792

Anafp

Chemical Formula: C₉₆H₁₅₁N₂₉O₃₃S₂
Average Mass: 2303.5500 Da
Monoisotopic Mass: 2302.04705 Da

Matched synonyms: … sulphanylpropylidene}amino)-1,3-dihydroxypropylidene]amino}-1-hydroxy-4-methylpentylidene)amino]butanoic acid …
Matched iupac: … acetamido)-4-carboxybutanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-4-methylpentanamido]butanoic acid …

NP0021387

Palytoxin

Chemical Formula: C₁₂₉H₂₂₃N₃O₅₄
Average Mass: 2680.1700 Da
Monoisotopic Mass: 2678.47959 Da

Matched synonyms: … tetrahydroxy-N-[(1E)-2-[(3-hydroxypropyl)-C-hydroxycarbonimidoyl]eth-1-en-1-yl]-3,7-dimethyldec-6-enimidic acid …

NP0044310

17364-16-8

LysoPC(16:0/0:0)

Chemical Formula: C₂₄H₅₀NO₇P
Average Mass: 495.6301 Da
Monoisotopic Mass: 495.33249 Da

Matched synonyms: … (2R)-2-Hydroxy-3-(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphoric acid …
Matched description: … Fatty acids containing 16, 18 and 20 carbons are the most common. ... The mead acid moiety is derived from fish oils, liver and kidney. ... Lysophosphatidylcholines can have different combinations of fatty acids of varying lengths and saturation …

NP0044403

3031-94-5

AICAR

Chemical Formula: C₉H₁₅N₄O₈P
Average Mass: 338.2112 Da
Monoisotopic Mass: 338.06275 Da

Matched synonyms: … Acadesine 5'-monophosphoric acid …
Matched iupac: … [(2R,3S,4R,5R)-5-(5-amino-4-carbamoyl-1H-imidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid …
Matched description: … In addition, 10-formyltetrahydrofolate and AICAR can be converted into tetrahydrofolic acid and phosphoribosyl ... In particular, fumaric acid and AICAR can be biosynthesized from SAICAR; which is catalyzed by the enzyme ... AICAR has been used clinically to treat and protect against cardiac ischemic injury. …

NP0085335

Cam-PDH

Chemical Formula: C₈₃H₁₄₃N₂₃O₂₇S
Average Mass: 1927.2500 Da
Monoisotopic Mass: 1926.02445 Da

Matched synonyms: … C-hydroxycarbonimidoyl}-2-methylbutyl]-C-hydroxycarbonimidoyl}-3-methylbutyl]-C-hydroxycarbonimidoyl}butanoic acid …
Matched iupac: … methylbutyl]carbamoyl}-4-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]butanoic acid …

NP0084696

Chenopodin

Chemical Formula: C₉₂H₁₅₄N₂₆O₃₇S
Average Mass: 2248.4500 Da
Monoisotopic Mass: 2247.06889 Da

Matched synonyms: … methylbutyl]-C-hydroxycarbonimidoyl}-2-(C-hydroxycarbonimidoyl)ethyl]-C-hydroxycarbonimidoyl}butanoic acid …
Matched iupac: … hydroxypropanamido]propanamido]-5-carbamimidamidopentanamido]-4-methylpentanamido]-3-hydroxypropanamido]butanoic acid …

NP0085415

Bass hepcidin

Chemical Formula: C₈₆H₁₃₅N₂₉O₂₅S₉
Average Mass: 2263.7400 Da
Monoisotopic Mass: 2261.76703 Da

Matched synonyms: … hydroxy-3-sulphanylpropylidene]amino}-5-carbamimidamido-1-hydroxypentylidene]amino}-3-phenylpropanoic acid …
Matched iupac: … methylbutanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-phenylpropanoic acid …

NP0086370

MCTI I

Chemical Formula: C₁₃₇H₂₂₅N₄₇O₄₀S₇
Average Mass: 3395.0200 Da
Monoisotopic Mass: 3392.50619 Da

Matched synonyms: … C-hydroxycarbonimidoyl}-2-methylbutyl]-C-hydroxycarbonimidoyl}-2-sulphanylethyl]-C-hydroxycarbonimidoyl}butanoic acid …
Matched iupac: … propyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid …

NP0085236

CmCTI-I

Chemical Formula: C₁₃₀H₂₁₉N₃₃O₃₉S₈
Average Mass: 3124.8500 Da
Monoisotopic Mass: 3122.39336 Da

Matched synonyms: … C-hydroxycarbonimidoyl}-2-phenylethyl]-C-hydroxycarbonimidoyl}methyl)-C-hydroxycarbonimidoyl]butanoic acid …
Matched iupac: … carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}-2-phenylethyl]carbamoyl}methyl)carbamoyl]butanoic acid …

NP0085567

CPTI II

Chemical Formula: C₁₃₅H₂₂₃N₃₇O₄₂S₇
Average Mass: 3260.9100 Da
Monoisotopic Mass: 3258.44963 Da

Matched synonyms: … C-hydroxycarbonimidoyl}methyl)-C-hydroxycarbonimidoyl]-2-(1H-imidazol-5-yl)ethyl]-C-hydroxycarbonimidoyl}butanoic acid …
Matched iupac: … formamido}hexanamido]-3-methylpentanamido]-4-methylpentanamido]-4-(methylsulfanyl)butanamido]butanoic acid …