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> Benzenoids / Phenols / Methoxyphenols
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4-Amino-3-methoxyphenol
|
19818056 |
Click to see
COC1=C(C=CC(=C1)O)N
|
139.15 |
unknown |
via CMAUP database |
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Feruloyltyramine
|
5280537 |
Click to see
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313.30 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
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methyl (1S,4S,5R,9S,10S,12S,13R)-12-[(Z)-4-hydroxypent-3-enoyl]oxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate
|
162974714 |
Click to see
CC(=CCC(=O)OC1CC2C3(CCCC(C3CCC24CC1C(=C)C4)(C)C(=O)OC)C)O
|
430.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes
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(6'S)-beta,epsilon-carotene
|
6419724 |
Click to see
CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CCCC2(C)C)C)C)C
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536.90 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
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Acetobetulinic acid
|
10300534 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)C)C)C(=O)O
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498.70 |
unknown |
via CMAUP database |
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Diosgenin
|
99474 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)OC1
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414.60 |
unknown |
via CMAUP database |
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Tigogenin
|
99516 |
Click to see
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416.60 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 3-hydroxysteroids / 3-beta-hydroxysteroids
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(1R,2S,4S,6R,7S,8R,9S,10R,12S,13R,16S)-7,9,13-trimethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-10,16-diol
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46833330 |
Click to see
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416.60 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Physalins and derivatives
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(1R,2R,4R,5R,8S,11R,13S,14S,15R,16S,19S,22S,23R,25S)-2,19-dihydroxy-13,16,23-trimethyl-6,10,17,26,27,30-hexaoxanonacyclo[23.2.2.15,14.15,15.01,23.04,22.08,13.011,16.015,19]hentriacont-28-ene-9,18,24,31-tetrone
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21633629 |
Click to see
CC12CC3C4(C56C1C(=O)C(O5)(C7CC(C89C=CC(C(=O)C8(C7CCC6(C(=O)O4)O)C)OO9)O)OCC2C(=O)O3)C
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558.50 |
unknown |
via CMAUP database |
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(1R,2S,5S,8S,9S,14R,15R,17R,18R,21S,24R,26S,27S)-14-chloro-5,15-dihydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-ene-4,10,22,29-tetrone
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10769263 |
Click to see
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563.00 |
unknown |
via CMAUP database |
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Physalin F
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49864133 |
Click to see
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526.50 |
unknown |
via CMAUP database |
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Physalin G
|
56683730 |
Click to see
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526.50 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Solanidines and derivatives
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Solanidine
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65727 |
Click to see
CC1CCC2C(C3C(N2C1)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C
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397.60 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Spirosolanes and derivatives
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(1R,2S,3'R,4S,6R,7S,8R,9S,10R,12S,13R,16S)-10,16-dihydroxy-7,9,13-trimethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,6'-piperidine]-3'-carboxylic acid
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21573758 |
Click to see
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459.60 |
unknown |
via CMAUP database |
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(1R,2S,4S,5'R,6R,7S,8R,9S,10R,12S,13R,16S)-5'-(hydroxymethyl)-7,9,13-trimethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-10,16-diol
|
21573757 |
Click to see
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445.60 |
unknown |
via CMAUP database |
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(1R,2S,4S,5'R,6R,7S,8R,9S,10R,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-10,16-diol
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21573755 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(CC5C4CC=C6C5(CCC(C6)O)C)O)C)C)NC1
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429.60 |
unknown |
via CMAUP database |
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N-Methylsolasodine
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21573751 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)N(C1)C
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427.70 |
unknown |
via CMAUP database |
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Solasodine
|
442985 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)NC1
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413.60 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins
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(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-5-hydroxy-6-(hydroxymethyl)-2-[(1R,2S,4S,5'R,6R,7S,8R,9S,10R,12S,13R,16S)-10-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
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21573761 |
Click to see
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900.10 |
unknown |
via CMAUP database |
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(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-2-methyl-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
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102058012 |
Click to see
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722.90 |
unknown |
via CMAUP database |
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Degalactotigonin
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162401 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)C)OC1
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1035.20 |
unknown |
via CMAUP database |
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Khasianine
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21573759 |
Click to see
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721.90 |
unknown |
via CMAUP database |
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Nigrumnin I
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10820113 |
Click to see
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1151.30 |
unknown |
via CMAUP database |
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nigrumnin II
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10630134 |
Click to see
CC1CCC2(C(C3(C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(CO2)O)O)O)O)OC2C(C(C(C(O2)C)O)O)O)C)C)O)C)OC1
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1181.30 |
unknown |
via CMAUP database |
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Solamargine
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73611 |
Click to see
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868.10 |
unknown |
via CMAUP database |
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Solanigroside C
|
16083118 |
Click to see
CC1CC(C2(C(C3C(O2)C(C4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(C(O9)CO)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)O)C)OC1=O)O
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1111.20 |
unknown |
via CMAUP database |
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Solanigroside D
|
16083121 |
Click to see
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1181.30 |
unknown |
via CMAUP database |
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Solanigroside E
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16083119 |
Click to see
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1197.30 |
unknown |
via CMAUP database |
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Solanigroside G
|
16083120 |
Click to see
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1051.20 |
unknown |
via CMAUP database |
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Solanigroside H
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16083123 |
Click to see
CC1CCC2(C(C3(C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)OC2C(C(C(C(O2)C)O)O)O)C)C)O)C)OC1
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1047.20 |
unknown |
via CMAUP database |
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Solasonine
|
119247 |
Click to see
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884.10 |
unknown |
via CMAUP database |
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Uttroside B
|
44566638 |
Click to see
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1215.30 |
unknown |
via CMAUP database |
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> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
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(-)-beta-Sitosterol
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222284 |
Click to see
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414.70 |
unknown |
via CMAUP database |
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> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids
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alpha-Glycine
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5257127 |
Click to see
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75.07 |
unknown |
via CMAUP database |
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> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
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[(1R,2R,4S,4aR,5R,8aR)-1-[2-acetyloxy-2-(furan-3-yl)ethyl]-4a-(acetyloxymethyl)-4-hydroxy-2-methylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]methyl acetate
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101634582 |
Click to see
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492.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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[(1S,2R,6R,7S,9S,11S,12S)-11-acetyloxy-1-[(2S)-2-acetyloxy-2-(furan-3-yl)ethyl]-12-methyl-8-oxospiro[10-oxatricyclo[7.2.1.02,7]dodecane-6,2'-oxirane]-7-yl]methyl acetate
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13966165 |
Click to see
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504.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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[(1S,2R,6R,7S,9S,11S,12S)-11-acetyloxy-1-[2-acetyloxy-2-(furan-3-yl)ethyl]-12-methyl-8-oxospiro[10-oxatricyclo[7.2.1.02,7]dodecane-6,2'-oxirane]-7-yl]methyl acetate
|
101635447 |
Click to see
CC1C2C(=O)C3(C(C1(C(O2)OC(=O)C)CC(C4=COC=C4)OC(=O)C)CCCC35CO5)COC(=O)C
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504.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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[1-[2-acetyloxy-2-(furan-3-yl)ethyl]-4a-(acetyloxymethyl)-4-hydroxy-2-methylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]methyl acetate
|
162952539 |
Click to see
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492.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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[11-Acetyloxy-1-[2-acetyloxy-2-(furan-3-yl)ethyl]-12-methyl-8-oxospiro[10-oxatricyclo[7.2.1.02,7]dodecane-6,2'-oxirane]-7-yl]methyl acetate
|
13966164 |
Click to see
|
504.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
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(1S,3R,4R,5R)-3-(3-(3,4-Dihydroxyphenyl)Prop-2-Enoyloxy)-1,4,5-Trihydroxycyclohexane-1-Carboxylic Acid
|
9476 |
Click to see
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354.31 |
unknown |
via CMAUP database |
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> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
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Qui3Me(b1-4)Oli3Me(a)-O-Et
|
101490302 |
Click to see
CCOC1CC(C(C(O1)C)OC2C(C(C(C(O2)C)O)OC)O)OC
|
350.40 |
unknown |
via CMAUP database |
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Qui3Me(b1-4)Oli3Me(b)-O-Et
|
101490301 |
Click to see
|
350.40 |
unknown |
via CMAUP database |
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> Organoheterocyclic compounds / Indoles and derivatives / Indoles / 3-alkylindoles
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Indolyl-3-ethanol acetate
|
588705 |
Click to see
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203.24 |
unknown |
via CMAUP database |
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> Organoheterocyclic compounds / Oxanes
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[(1S)-2-[(1R,2R,6S,7S,8R,11R,13S)-8,11-dihydroxy-13-methyl-12-oxospiro[9-oxatricyclo[5.3.3.01,6]tridecane-2,2'-oxirane]-7-yl]-1-(furan-3-yl)ethyl] acetate
|
162915275 |
Click to see
|
420.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
|
[(1S)-2-[(2R,6S,8S,11R,13S)-8,11-dihydroxy-13-methyl-12-oxospiro[9-oxatricyclo[5.3.3.01,6]tridecane-2,2'-oxirane]-7-yl]-1-(furan-3-yl)ethyl] acetate
|
101920264 |
Click to see
CC1C(=O)C(C23COC(C1(C2CCCC34CO4)CC(C5=COC=C5)OC(=O)C)O)O
|
420.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
|
[2-(8,11-Dihydroxy-13-methyl-12-oxospiro[9-oxatricyclo[5.3.3.01,6]tridecane-2,2'-oxirane]-7-yl)-1-(furan-3-yl)ethyl] acetate
|
162915274 |
Click to see
|
420.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)97562-9 |
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> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
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2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, ethyl ester
|
65133 |
Click to see
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222.24 |
unknown |
via CMAUP database |
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Ethyl Caffeate
|
5317238 |
Click to see
|
208.21 |
unknown |
via CMAUP database |
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Methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
|
159894 |
Click to see
|
238.24 |
unknown |
via CMAUP database |
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> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
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3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid
|
2518 |
Click to see
|
180.16 |
unknown |
via CMAUP database |
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> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides
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[(2S,3R,4S,5R,6R)-6-[[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4,5-dihydroxy-2-methyloxan-3-yl] 3-(4-hydroxyphenyl)prop-2-enoate
|
101243377 |
Click to see
|
933.80 |
unknown |
via CMAUP database |