|
> Alkaloids and derivatives / Cytochalasans / Chaetoglobosins
|
|
Chaetoglobosin A
|
6438437 |
Click to see
|
528.60 |
unknown |
via CMAUP database |
|
> Benzenoids / Phenol ethers / Anisoles
|
|
1,2,3-Trimethoxybenzene
|
12462 |
Click to see
COC1=C(C(=CC=C1)OC)OC
|
168.19 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
|
4beta-Acetoxy-9beta-10beta-15alpha-trihydroxyprobotrydial
|
44584588 |
Click to see
|
312.40 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
|
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid
|
21635582 |
Click to see
|
957.10 |
unknown |
via CMAUP database |
|
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-carboxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid
|
101923141 |
Click to see
|
795.00 |
unknown |
via CMAUP database |
|
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate
|
11803947 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC6(C(=CCC7C6(CCC8C7(CCC(C8(C)C)O)C)C)C4CC(C(=O)C5)(C)C)C)O)O)O)CO)O)O)O
|
941.10 |
unknown |
via CMAUP database |
|
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-6-(acetyloxymethyl)-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate
|
10819773 |
Click to see
|
983.10 |
unknown |
via CMAUP database |
|
Calenduloside E
|
176079 |
Click to see
|
632.80 |
unknown |
via CMAUP database |
|
chikusetsusaponin IV
|
10079497 |
Click to see
|
927.10 |
unknown |
via CMAUP database |
|
Chikusetsusaponin Iva
|
13909684 |
Click to see
|
795.00 |
unknown |
via CMAUP database |
|
Glycoside ST-J
|
101720880 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC(CC4C6=CCC7C8(CCC(C(C8CCC7(C6(CC5)C)C)(C)C)OC9C(C(C(C(O9)C(=O)O)O)O)O)C)(C)C)O)O)O)CO)O)O)O
|
1103.20 |
unknown |
via CMAUP database |
|
methyl (2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylate
|
21669007 |
Click to see
|
971.10 |
unknown |
via CMAUP database |
|
Narcissiflorine
|
162878 |
Click to see
|
764.90 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
|
(1R,5R,8S,11R,14S,17R,18S,21S,24R)-21-hydroxy-5,8,11,14,17,24-hexamethyl-22-oxahexacyclo[19.2.1.01,18.04,17.05,14.08,13]tetracosane-11-carboxylic acid
|
10434964 |
Click to see
|
472.70 |
unknown |
via CMAUP database |
|
(3R,4aR,6aR,6aS,6bR,8aR,10R,12aS)-3,10-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-4a-carboxylic acid
|
101277261 |
Click to see
|
470.70 |
unknown |
via CMAUP database |
|
(3R,4aR,6aR,6aS,6bR,8aR,12aS)-3-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12-decahydro-1H-picene-4a-carboxylic acid
|
101277260 |
Click to see
CC1(CC2=C3C=CC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CC1O)C(=O)O)C)C)(C)C)C)C
|
468.70 |
unknown |
via CMAUP database |
|
(3R,4R,4aS,6aR,6aS,6bR,8aR,10R,12aS)-3,4,10-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-4a-carboxylic acid
|
16112781 |
Click to see
|
486.70 |
unknown |
via CMAUP database |
|
(4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
15379012 |
Click to see
CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C)OC6C(C(C(CO6)O)O)O)C)C(=O)O)C
|
604.80 |
unknown |
via CMAUP database |
|
(4aR,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
|
102239749 |
Click to see
|
470.70 |
unknown |
via CMAUP database |
|
(4aR,6aR,6aS,6bR,8aR,10S,12aS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12-decahydro-1H-picene-4a-carboxylic acid
|
16112782 |
Click to see
|
468.70 |
unknown |
via CMAUP database |
|
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
10395290 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)OC7C(C(C(C(O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C
|
751.00 |
unknown |
via CMAUP database |
|
(6Z,10E,14Z,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
|
25244109 |
Click to see
CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
|
410.70 |
unknown |
via CMAUP database |
|
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,6aR,6bS,8aR,10R,12aS,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,7,8,8a,10,11,12,14b-decahydro-1H-picene-4a-carboxylate
|
10605857 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OCC3C(C(C(C(O3)OC(=O)C45CCC6(C(=CC=C7C6(CCC8C7(CCC(C8(C)C)O)C)C)C4CC(C(=O)C5)(C)C)C)O)O)O)CO)O)O)O
|
939.10 |
unknown |
via CMAUP database |
|
[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aR,6aR,6bS,8aR,12aS,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-3,10-dioxo-1,4,5,6,7,8,8a,11,12,14b-decahydropicene-4a-carboxylate
|
10748397 |
Click to see
|
937.10 |
unknown |
via CMAUP database |
|
2,4a,6a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picene-2-carboxylic acid
|
343427 |
Click to see
|
456.70 |
unknown |
via CMAUP database |
|
asperosaponin C
|
13878127 |
Click to see
|
588.80 |
unknown |
via CMAUP database |
|
Beta-Amyrin
|
73145 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C
|
426.70 |
unknown |
via CMAUP database |
|
Papyriogenin A
|
3081523 |
Click to see
CC1(CC2=C3C=CC4C5(CCC(=O)C(C5CCC4(C3(CCC2(CC1=O)C(=O)O)C)C)(C)C)C)C
|
466.70 |
unknown |
via CMAUP database |
|
Papyriogenin C
|
3081568 |
Click to see
|
468.70 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
|
(3S,10R,13R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
|
21775588 |
Click to see
CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C
|
396.60 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
|
(3R,4S,5S,6R)-2-[[(3S,8S,9S,10R,13R,14S)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
52940117 |
Click to see
|
576.80 |
unknown |
via CMAUP database |
|
Sitogluside
|
5742590 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
via CMAUP database |
|
> Nucleosides, nucleotides, and analogues / 5-deoxyribonucleosides
|
|
2',3'-di-O-acetyl-5'-deoxy-5-fluorocytidine
|
11809635 |
Click to see
CC1C(C(C(O1)N2C=C(C(=NC2=O)N)F)OC(=O)C)OC(=O)C
|
329.28 |
unknown |
via CMAUP database |
|
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives
|
|
[(3S)-3-amino-3-carboxypropyl]-[[(2R,3R)-2-(6-aminopurin-9-yl)-3-hydroxy-2,3-dihydrofuran-5-yl]methyl]-methylsulfanium
|
100991253 |
Click to see
C[S+](CCC(C(=O)O)N)CC1=CC(C(O1)N2C=NC3=C(N=CN=C32)N)O
|
381.40 |
unknown |
via CMAUP database |
|
> Organic acids and derivatives / Peptidomimetics / Depsipeptides / Cyclic depsipeptides
|
|
cyclo[Ala-Val-ObAla(3-hexyl)-Gly-Val-Leu]
|
102145514 |
Click to see
|
595.80 |
unknown |
via CMAUP database |
|
Isaridine A
|
12111222 |
Click to see
|
703.90 |
unknown |
via CMAUP database |
|
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar alcohols
|
|
L-Iditol
|
5460044 |
Click to see
|
182.17 |
unknown |
via CMAUP database |
|
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
|
|
(4aR,6aR,6bS,14aR,14bS)-4,4,6a,6b,11,11,14b-heptamethyl-2,4a,5,6,7,8,12,14a-octahydro-1H-picene-3,10-dione
|
102588576 |
Click to see
|
420.60 |
unknown |
via CMAUP database |
|
3alpha-Hydroxy-28-noroleana-11,13(18),17(22)-triene-21-one
|
102588575 |
Click to see
CC1(CC2=C3C=CC4C5(CCC(C(C5CCC4(C3(CCC2=CC1=O)C)C)(C)C)O)C)C
|
422.60 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Benzofurans
|
|
1-Benzofuran-5-carbaldehyde
|
2773875 |
Click to see
C1=CC2=C(C=CO2)C=C1C=O
|
146.14 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Isoindoles and derivatives / Isoindolines / Isoindolones
|
|
(1R,3Z,6R,7Z,9S,11Z,13R,14S,17R,18S)-6,14-dihydroxy-18-(1H-indol-3-ylmethyl)-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-3,7,11,15-tetraene-2,5,20-trione
|
102093916 |
Click to see
|
528.60 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Lactones / Beta propiolactones
|
|
(1S,2R,5R,7R,10S,11R,18S,19S,22S)-7,18-dihydroxy-1,2,6,6,10,17,17-heptamethyl-20-oxahexacyclo[12.10.0.02,11.05,10.015,22.019,22]tetracosa-12,14-dien-21-one
|
101967008 |
Click to see
|
468.70 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Quinolines and derivatives / Benzoquinolines / Phenanthridines and derivatives
|
|
[3,4-diacetyloxy-6-(8-hydroxy-1,7,12-trioxo-3,4-dihydro-2H-benzo[j]phenanthridin-9-yl)oxan-2-yl]methyl acetate
|
51340760 |
Click to see
|
565.50 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / 3,4-dihydrocoumarins
|
|
Dihydrocoumarin
|
660 |
Click to see
|
148.16 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Cinnamyl alcohols
|
|
3-Phenylprop-2-En-1-Ol
|
308 |
Click to see
|
134.17 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Coumarins and derivatives
|
|
Coumarin
|
323 |
Click to see
|
146.14 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavones
|
|
3,7,4'-Tri-O-Acetyl Kaempferol
|
44584293 |
Click to see
|
412.30 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
|
|
Kaempferol
|
5280863 |
Click to see
|
286.24 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
|
Afzelin
|
5316673 |
Click to see
|
432.40 |
unknown |
via CMAUP database |
|
Astragalin
|
5282102 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
|
kaempferol 7-O-(2-E-p-coumaroyl-alpha-L-rhamnopyranoside)
|
11678667 |
Click to see
|
578.50 |
unknown |
via CMAUP database |
|
kaempferol 7-O-(2,3-di-E-p-coumaroyl-alpha-L-rhamnopyranoside)
|
11607311 |
Click to see
|
724.70 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Macrolactams
|
|
[(18E)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] 2-[methyl(2-methylpropanoyl)amino]propanoate
|
54610539 |
Click to see
|
720.20 |
unknown |
via CMAUP database |
|
[(1S,2R,3S,5S,6S,16E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] (2S)-2-[acetyl(methyl)amino]propanoate
|
54604312 |
Click to see
CC1C2CC(C(C=CC=C(CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)N(C)C(=O)C)C)C)OC)(NC(=O)O2)O
|
692.20 |
unknown |
via CMAUP database |
|
Maytanprine
|
54610538 |
Click to see
|
706.20 |
unknown |
via CMAUP database |