> Alkaloids and derivatives / Indolonaphthyridine alkaloids
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2-Methoxycanthin-6-one
|
10106139 |
Click to see
COC1=NC2=C3C(=C1)C4=CC=CC=C4N3C(=O)C=C2
|
250.25 |
unknown |
https://doi.org/10.1016/S0024-3205(97)00615-2 https://doi.org/10.1055/S-2006-958044 |
Nigakinone
|
5320161 |
Click to see
COC1=C(C(=O)N2C3=CC=CC=C3C4=C2C1=NC=C4)O
|
266.25 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1055/S-2006-960928 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Quassinoids
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(+)-Simalikalactone
|
15161842 |
Click to see
CCC(C)C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
|
478.50 |
unknown |
https://doi.org/10.1016/J.JEP.2006.04.017 |
(1S,2S,3R,6S,7S,9R,13R,17S)-3,4,15-trimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-11,16-dione
|
10046818 |
Click to see
CC1C=C(C(C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC)OC
|
404.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
(1S,2S,4S,5S,7S,8S,10R,14R,18S)-4-hydroxy-16-methoxy-2,15,18-trimethyl-11-oxapentacyclo[8.7.1.02,8.05,7.014,18]octadec-15-ene-3,12,17-trione
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163009184 |
Click to see
CC1=C(C(=O)C2C3(C(CC4C2(C1CC(=O)O4)C)C5CC5C(C3=O)O)C)OC
|
374.40 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.12.001 |
(1S,2S,6S,7S,9R,11R,13R,16S,17S)-4,11,15-trimethoxy-2,6,14,17-tetramethyl-16-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-dien-3-one
|
163009996 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=C(C4CC(O3)OC)C)OC)OC5C(C(C(C(O5)CO)O)O)O)C)C)OC
|
568.70 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
(1S,2S,6S,7S,9R,11S,13S,14R,16S,17S)-11,16-dihydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,15-dione
|
163068582 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(O3)O)C)O)C)C)OC
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378.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)84604-X |
(1S,2S,6S,7S,9R,13S,14R,15S,17S)-15-hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11,16-trione
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102059841 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(C(C4CC(=O)O3)C)O)C)C)OC
|
376.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1016/0031-9422(93)85245-M |
(1S,2S,6S,7S,9R,13S,14R,16S,17S)-16-hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11,15-trione
|
102059849 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)O)C)C)OC
|
376.40 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)84604-X |
(1S,2S,6S,7S,9R,13S,15R,16S,17S)-15,16-dihydroxy-4-methoxy-2,6,17-trimethyl-14-methylidene-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11-dione
|
11740247 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(C(=C)C4CC(=O)O3)O)O)C)C)OC
|
376.40 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
(1S,2S,6S,7S,9R,13S,17S)-15-(hydroxymethyl)-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,11,16-trione
|
101703196 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)CO)C)C)OC
|
388.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)82622-9 https://doi.org/10.1016/S0021-9673(00)96287-3 https://doi.org/10.1076/PHBI.34.5.349.13243 |
(2S,6R,7R,9R,13R,17S)-11-Hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,16-dione
|
20054979 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(O3)O)C)OC)C)C)OC
|
390.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)82622-9 https://doi.org/10.1076/PHBI.34.5.349.13243 https://doi.org/10.1016/S0031-9422(00)84604-X |
(4-Methoxy-2,6,14,17-tetramethyl-3,11,15-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl) acetate
|
162851944 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)OC(=O)C)C)C)OC
|
418.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
[(1R,2S,3R,6R,8S,12S,13S,14R,15R,16S,17S)-12,15,16-trihydroxy-9,13,17-trimethyl-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-en-3-yl] (2S)-2-acetyloxy-2-methylbutanoate
|
44566234 |
Click to see
CCC(C)(C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C)OC(=O)C
|
536.60 |
unknown |
https://doi.org/10.1021/JO00883A038 |
[(1R,2S,3R,6R,8S,12S,13S,14R,15R,16S)-12,15,16-trihydroxy-9,13,17-trimethyl-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-en-3-yl] 2-methylbutanoate
|
320171 |
Click to see
CCC(C)C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
|
478.50 |
unknown |
https://doi.org/10.1016/J.JEP.2006.04.017 |
[(1S,2S,6S,7S,9R,13S,14R,16S,17S)-4-methoxy-2,6,14,17-tetramethyl-3,11,15-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-16-yl] acetate
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162851945 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)OC(=O)C)C)C)OC
|
418.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
11-alpha-O-beta-D-Glucopyranosyl-16alpha-O-methylneoquassin
|
131752723 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=C(C4CC(O3)OC)C)OC)OC5C(C(C(C(O5)CO)O)O)O)C)C)OC
|
568.70 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
11-Dihydro-12-norneoquassin
|
494573 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(O3)O)C)O)C)C)OC
|
378.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)84604-X |
11,14,16-Trihydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,15-dione
|
163192414 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(O3)O)(C)O)O)C)C)OC
|
394.50 |
unknown |
https://doi.org/10.1076/PHBI.34.5.349.13243 |
12alpha-Hydroxy-13,18-dehydroparain
|
73081379 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(C(=C)C4CC(=O)O3)O)O)C)C)OC
|
376.40 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
15-Hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-ene-3,11,16-trione
|
162915026 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(C(C4CC(=O)O3)C)O)C)C)OC
|
376.40 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)84604-X |
1alpha-O-Methylquassin
|
85102744 |
Click to see
CC1C=C(C(C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC)OC
|
404.50 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione
|
65571 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC
|
388.50 |
unknown |
https://doi.org/10.1076/PHBI.34.5.349.13243 https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1055/S-2006-958044 https://doi.org/10.1016/S0021-9673(00)96287-3 https://doi.org/10.1055/S-2006-959664 https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0024-3205(97)00615-2 |
beta-Neoquassin
|
5320109 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(O3)O)C)OC)C)C)OC
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1016/0031-9422(93)85245-M |
Nigakihemiacetal B
|
283906 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(O3)O)C)OC)C)C)OC
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1016/0031-9422(93)85245-M |
Nigakilactone A
|
10452259 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(C(C4CC(=O)O3)C)O)O)C)C)OC
|
378.50 |
unknown |
https://doi.org/10.1076/PHBI.34.5.349.13243 |
Picras-2-ene-1,16-dione, 11,12-dihydroxy-2-methoxy-, (11alpha,12beta)-
|
328258 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(C(C(C4CC(=O)O3)C)O)O)C)C)OC
|
378.50 |
unknown |
https://doi.org/10.1076/PHBI.34.5.349.13243 |
Quassimarin
|
429906 |
Click to see
CCC(C)(C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C)OC(=O)C
|
536.60 |
unknown |
https://doi.org/10.1021/JO00883A038 |
Quassin
|
4998 |
Click to see
CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC
|
388.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1016/0031-9422(93)85245-M |
Simalikalactone D
|
441808 |
Click to see
CCC(C)C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
|
478.50 |
unknown |
https://doi.org/10.1055/S-2006-962709 https://doi.org/10.1021/JO00883A038 |
Similikalactone D
|
500023 |
Click to see
CCC(C)C(=O)OC1C2C3(C(C(C4C2(CO3)C(CC5C4(C(C(=O)C=C5C)O)C)OC1=O)O)O)C
|
478.50 |
unknown |
https://doi.org/10.1016/J.JEP.2006.04.017 https://doi.org/10.1021/JO00883A038 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
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Stigmast-4-en-3-one
|
5484202 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1055/S-2006-962709 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
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(1S,3'aR,4R,5R,8R,9R,12R,13S)-4-(furan-3-yl)-4',4',5,9,12-pentamethylspiro[3,10,14-trioxatetracyclo[7.4.1.01,5.08,12]tetradecane-13,2'-3,3a-dihydrofuro[3,2-c]pyran]-2,6',11-trione
|
102202714 |
Click to see
CC1(C2CC3(C4(C5CCC6(C3(C(=O)OC6C7=COC=C7)OC5(OC4=O)C)C)C)OC2=CC(=O)O1)C
|
484.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1016/0031-9422(93)85245-M |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
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beta-D-Glucopyranoside, methyl
|
2108 |
Click to see
COC1C(C(C(C(O1)CO)O)O)O
|
194.18 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
Methyl alpha-D-glucopyranoside
|
64947 |
Click to see
COC1C(C(C(C(O1)CO)O)O)O
|
194.18 |
unknown |
https://doi.org/10.1016/0031-9422(93)85245-M |
> Organoheterocyclic compounds / Oxanes
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8-Acetyl-9,13-dihydroxy-4,13-dimethyl-6,11-dioxatetracyclo[7.4.0.03,7.010,12]trideca-1,3-dien-5-one
|
162789741 |
Click to see
CC1=C2C=C3C(C4C(C3(C(C2OC1=O)C(=O)C)O)O4)(C)O
|
292.28 |
unknown |
https://doi.org/10.1016/S0031-9422(00)82622-9 https://doi.org/10.1016/S0021-9673(00)96287-3 https://doi.org/10.1055/S-2006-959664 https://doi.org/10.1076/PHBI.34.5.349.13243 https://doi.org/10.1016/0031-9422(93)85245-M https://doi.org/10.1016/S0031-9422(00)84604-X https://doi.org/10.1055/S-2006-958044 https://doi.org/10.1016/S0024-3205(97)00615-2 |