NP-MRD: Search Results for natural products

Searching natural products for "acetic acid" AND biofluid_source:urine returned 91557 results.
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NP0073401

(+)-Caratuberside G

Chemical Formula: C₆₂H₈₈O₂₁
Average Mass: 1169.3650 Da
Monoisotopic Mass: 1168.58181 Da

Matched synonyms: … methoxy-6-methyloxan-2-yl]oxy}-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-7-en-14-yl]ethyl benzoic acid …

NP0073701

(-)-Russelioside E

Chemical Formula: C₅₇H₈₆O₂₁
Average Mass: 1107.2940 Da
Monoisotopic Mass: 1106.56616 Da

Matched synonyms: … oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-7-en-16-yl benzoic acid …

NP0076946

(+)-Perennisoside VI

Chemical Formula: C₅₆H₉₀O₂₅
Average Mass: 1163.3110 Da
Monoisotopic Mass: 1162.57712 Da

Matched synonyms: … oxan-2-yl]oxy}-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid …

NP0077137

Schulzeine C

Chemical Formula: C₄₁H₇₀N₂O₁₆S₃
Average Mass: 943.1900 Da
Monoisotopic Mass: 942.38875 Da

Matched synonyms: … 4-oxo-1H,2H,3H,4H,6H,7H,11BH-pyrido[2,1-a]isoquinolin-3-yl]-14,17,18-tris(sulphooxy)octacosanimidic acid …
Matched iupac: … 6H,7H,11bH-pyrido[2,1-a]isoquinolin-3-yl]carbamoyl}-16,17-bis(sulfooxy)heptacosan-13-yl]oxy}sulfonic acid …

NP0078072

Polygalasaponin VII

Chemical Formula: C₅₄H₈₈O₂₄
Average Mass: 1121.2740 Da
Monoisotopic Mass: 1120.56655 Da

Matched synonyms: … 9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid …

NP0079326

(-)-Symplocososide D

Chemical Formula: C₆₆H₁₀₆O₂₃
Average Mass: 1267.5510 Da
Monoisotopic Mass: 1266.71249 Da

Matched synonyms: … }-4-hydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylic acid …

NP0081825

(-)-Hoodigoside Z

Chemical Formula: C₅₃H₈₆O₁₉
Average Mass: 1027.2520 Da
Monoisotopic Mass: 1026.57633 Da

Matched synonyms: … methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl (2E)-2-methylbut-2-enoic acid …

NP0092256

PGP(18:1(11Z)/18:3(9Z,12Z,15Z))

Chemical Formula: C₄₂H₇₆O₁₃P₂
Average Mass: 850.9926 Da
Monoisotopic Mass: 850.47612 Da

Matched synonyms: … 3-sn-Phosphatidyl-1'-sn-glycerol 3'-phosphoric acid …
Matched iupac: … 11-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphoryl}oxy)propoxy]phosphonic acid …

NP0092261

PGP(18:1(9Z)/18:3(9Z,12Z,15Z))

Chemical Formula: C₄₂H₇₆O₁₃P₂
Average Mass: 850.9926 Da
Monoisotopic Mass: 850.47612 Da

Matched synonyms: … 3-sn-Phosphatidyl-1'-sn-glycerol 3'-phosphoric acid …
Matched iupac: … -9-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphoryl}oxy)propoxy]phosphonic acid …

NP0092264

PGP(18:2(9Z,12Z)/18:3(9Z,12Z,15Z))

Chemical Formula: C₄₂H₇₄O₁₃P₂
Average Mass: 848.9767 Da
Monoisotopic Mass: 848.46047 Da

Matched synonyms: … 3-sn-Phosphatidyl-1'-sn-glycerol 3'-phosphoric acid …
Matched iupac: … 9,12,15-trienoyloxy]-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propoxy]phosphoryl}oxy)propoxy]phosphonic acid …

NP0136435

Glutaminyltryptophan

Chemical Formula: C₁₆H₂₀N₄O₄
Average Mass: 332.3600 Da
Monoisotopic Mass: 332.14846 Da

Matched synonyms: … (2S)-2-{[(2S)-2,5-diamino-5-oxopentanoyl]amino}-3-(1H-indol-3-yl)propanoic acid …
Matched iupac: … (2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-indol-3-yl)propanoic acid …

NP0339288

PGP(16:1(9Z)/20:3(8Z,11Z,14Z))

Chemical Formula: C₄₂H₇₆O₁₃P₂
Average Mass: 850.9926 Da
Monoisotopic Mass: 850.47612 Da

Matched synonyms: … 3-sn-Phosphatidyl-1'-sn-glycerol 3'-phosphoric acid …
Matched iupac: … (8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy]phosphonic acid …

NP0048164

5532-41-2

Isoarborinol

Chemical Formula: C₃₀H₅₀O
Average Mass: 426.7174 Da
Monoisotopic Mass: 426.38617 Da

Matched synonyms: … 4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranuronosyl]-beta-D-glucopyranosiduronic acid …

NP0049115

499-30-9

Gluconasturtiin

Chemical Formula: C₁₅H₂₁NO₉S₂
Average Mass: 423.4590 Da
Monoisotopic Mass: 423.06577 Da

Matched synonyms: … (3-phenyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}propylidene)amino]oxy}sulphonic acid …
Matched iupac: … )-(3-phenyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}propylidene)amino]oxy}sulfonic acid …

NP0073045

(+)-Marstomentoside N

Chemical Formula: C₅₅H₉₀O₂₂
Average Mass: 1103.3030 Da
Monoisotopic Mass: 1102.59237 Da

Matched synonyms: … methyloxan-2-yl]oxy}-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadecan-14-yl]ethyl (2E)-2-methylbut-2-enoic acid …

NP0073400

(+)-Caratuberside F

Chemical Formula: C₅₇H₈₆O₂₂
Average Mass: 1123.2930 Da
Monoisotopic Mass: 1122.56107 Da

Matched synonyms: … oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-2,15-dimethyltetracyclo[8.7.0.0,.0,]heptadec-8-en-16-yl benzoic acid …

NP0077871

(-)-Adociasulfate 6

Chemical Formula: C₃₆H₅₄O₆S
Average Mass: 614.8800 Da
Monoisotopic Mass: 614.36411 Da

Matched synonyms: … 1,5,14,18,22,22,26-heptamethyl-27-oxaheptacyclo[15.13.0.0,.0,.0,.0,.0,]triaconta-6,8,10-trien-7-yl]oxidanesulphonic acid …
Matched iupac: … 15.13.0.0^{2,14}.0^{5,13}.0^{6,11}.0^{18,28}.0^{21,26}]triaconta-6(11),7,9-trien-7-yl]oxidanesulfonic acid …

NP0085239

Batataoside III

Chemical Formula: C₆₅H₁₀₂O₂₅
Average Mass: 1283.5060 Da
Monoisotopic Mass: 1282.67102 Da

Matched synonyms: … methyloxan-2-yl]oxy}oxan-3-yl]oxy}-4-{[(2E)-3-phenylprop-2-enoyl]oxy}oxan-3-yl (2S)-2-methylbutanoic acid …

NP0092260

PGP(18:1(9Z)/18:3(6Z,9Z,12Z))

Chemical Formula: C₄₂H₇₆O₁₃P₂
Average Mass: 850.9926 Da
Monoisotopic Mass: 850.47612 Da

Matched synonyms: … 3-sn-Phosphatidyl-1'-sn-glycerol 3'-phosphoric acid …
Matched iupac: … octadec-9-enoyloxy]-2-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propoxy]phosphoryl}oxy)propoxy]phosphonic acid …

NP0136501

Histidylphenylalanine

Chemical Formula: C₁₅H₁₈N₄O₃
Average Mass: 302.3340 Da
Monoisotopic Mass: 302.13789 Da

Matched synonyms: … (2S)-2-{[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]amino}-3-phenylpropanoic acid …
Matched iupac: … (2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanoic acid …

NP0137219

Clematichinenoside AR

Chemical Formula: C₈₂H₁₃₄O₄₃
Average Mass: 1807.9310 Da
Monoisotopic Mass: 1806.82988 Da

Matched synonyms: … 9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid …

NP0256451

methyl (4s,5r,6s)-5-ethenyl-4-{9h-pyrido[3,4-b]indol-1-ylmethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylate

Chemical Formula: C₃₈H₄₀N₂O₁₃
Average Mass: 732.7390 Da
Monoisotopic Mass: 732.25304 Da

Matched synonyms: … propenoyl]-b-D-glucopyranosyloxy]-3,4-dihydro-4-(9H-pyrido[3,4-b]indole-1-ylmethyl)-2H-pyran-5-carboxylic acid ... propenoyl]-β-D-glucopyranosyloxy]-3,4-dihydro-4-(9H-pyrido[3,4-b]indole-1-ylmethyl)-2H-pyran-5-carboxylic acid …

NP0076953

(-)-Pescaprein X

Chemical Formula: C₇₀H₁₁₂O₂₅
Average Mass: 1353.6410 Da
Monoisotopic Mass: 1352.74927 Da

Matched synonyms: … (11S)-Jalapinolic acid 11-O-alpha-L-rhamnopyranosyl-(1->3)-O-[3-O-(trans-cinnamoyl)-4-O-(2S-methylbutanoyl ... (11S)-Jalapinolic acid 11-O-a-L-rhamnopyranosyl-(1->3)-O-[3-O-(trans-cinnamoyl)-4-O-(2S-methylbutanoyl ... (11S)-Jalapinolic acid 11-O-α-L-rhamnopyranosyl-(1->3)-O-[3-O-(trans-cinnamoyl)-4-O-(2S-methylbutanoyl …

NP0000204

17094-01-8

Sepiapterin

Chemical Formula: C₉H₁₁N₅O₃
Average Mass: 237.2153 Da
Monoisotopic Mass: 237.08619 Da

Matched synonyms: … 2-Amino-7,8-dihydro-6-((2S)-2-hydroxy-1-oxopropyl)-4(3H)-pteridinone acid …
Matched description: … , muscle spasms, and uncontrolled movements, especially of the head and neck. ... Most affected individuals have delayed development of motor skills such as sitting and crawling, and ... These episodes involve abnormal rotation of the eyeballs; extreme irritability and agitation; and pain …

NP0014466

Actinotetraose L

Chemical Formula: C₅₆H₈₂O₂₇
Average Mass: 1187.2450 Da
Monoisotopic Mass: 1186.50435 Da

Matched synonyms: … hydroxymethyl)-4,5-bis({[(2E)-2-methylbut-2-enoyl]oxy})oxan-2-yl]oxy}oxan-2-yl]methyl (2E)-2-methylbut-2-enoic acid …