(S,E)-Zearalenone

14,16-dihydroxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecine-1,7-dione

C18H22O5 (318.1467)


CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4903; ORIGINAL_PRECURSOR_SCAN_NO 4902 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4907; ORIGINAL_PRECURSOR_SCAN_NO 4903 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4915; ORIGINAL_PRECURSOR_SCAN_NO 4913 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4892; ORIGINAL_PRECURSOR_SCAN_NO 4888 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4889; ORIGINAL_PRECURSOR_SCAN_NO 4888 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4992; ORIGINAL_PRECURSOR_SCAN_NO 4988 Fungal metabolite of Fusarium subspecies and of Gibberella zeae. Potential food mycotoxin. Has weak estrogenic activity and causes physiol. changes when ingested by animals as foodstuffs contaminant. (S,E)-Zearalenone is found in corn. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens Acquisition and generation of the data is financially supported in part by CREST/JST. D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2248 cis-Zearalenone is a metabolite of Fusarium species. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2]. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2].

   

3,9,15-Tribenzyl-4,10,16-trimethyl-6,12,18-tri(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone

3,9,15-tribenzyl-4,10,16-trimethyl-6,12,18-tris(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone

C45H57N3O9 (783.4095)


[Raw Data] CBA19_Beauvericin_pos_20eV_1-1_01_1374.txt [Raw Data] CBA19_Beauvericin_pos_50eV_1-1_01_1485.txt [Raw Data] CBA19_Beauvericin_pos_10eV_1-1_01_1352.txt [Raw Data] CBA19_Beauvericin_pos_40eV_1-1_01_1376.txt [Raw Data] CBA19_Beauvericin_pos_30eV_1-1_01_1483.txt Beauvericin is a Fusarium mycotoxin. Beauvericin inhibits acyl-CoA: cholesterol acyltransferase (ACAT) activity with an IC50 of 3 μM in an enzyme assay using rat liver microsomes[1]. Beauvericin is a Fusarium mycotoxin. Beauvericin inhibits acyl-CoA: cholesterol acyltransferase (ACAT) activity with an IC50 of 3 μM in an enzyme assay using rat liver microsomes[1].

   

Diacetoxyscirpenol

[11-(Acetyloxy)-10-hydroxy-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-2-yl]methyl acetic acid

C19H26O7 (366.1678)


Diacetoxyscirpenol is a constituent of Fusarium species Mycotoxin D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins Constituent of Fusarium subspecies Mycotoxin C784 - Protein Synthesis Inhibitor D000970 - Antineoplastic Agents

   

Deoxynivalenol

3,10-dihydroxy-2-(hydroxymethyl)-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-4-one

C15H20O6 (296.126)


Deoxynivalenol is found in cereals and cereal products. Deoxynivalenol is produced by Fusarium graminearum and Fusarium roseum, responsible for headblight in cereals Vomitoxin, also known as deoxynivalenol (DON), is a type B trichothecene, an epoxy-sesquiterpeneoid. This mycotoxin occurs predominantly in grains such as wheat, barley, oats, rye, and maize, and less often in rice, sorghum, and triticale. The occurrence of deoxynivalenol is associated primarily with Fusarium graminearum (Gibberella zeae) and F. culmorum, both of which are important plant pathogens which cause Fusarium head blight in wheat and Gibberella ear rot in maize. Deoxynivalenol is a direct relationship between the incidence of Fusarium head blight and contamination of wheat with deoxynivalenol has been established. The incidence of Fusarium head blight is strongly associated with moisture at the time of flowering (anthesis), and the timing of rainfall, rather than the amount, is the most critical factor. Furthermore, deoxynivalenol contents are significantly affected by the susceptibility of cultivars towards Fusarium species, previous crop, tillage practices, and fungicide us Production by Fusarium graminearum and Fusarium roseum, responsible for headblight in cereals D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Moniliformin

3-hydroxycyclobut-3-ene-1,2-dione

C4H2O3 (98.0004)


   

xi-gamma-Undecalactone

2(3H)-Furanone, 5-heptyldihydro-

C11H20O2 (184.1463)


(±)-5-Heptyldihydro-2(3H)-furanone is a flavouring ingredient. [Raw Data] CB092_gamma-Undecalactone_pos_20eV_CB000039.txt [Raw Data] CB092_gamma-Undecalactone_pos_30eV_CB000039.txt [Raw Data] CB092_gamma-Undecalactone_pos_10eV_CB000039.txt

   

toxin HT 2

[(1S,2R,4S,7R,9R,10R,11S,12S)-2-(acetyloxymethyl)-10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-4-yl] 3-methylbutanoate

C22H32O8 (424.2097)


HT-2 toxin is a trichothecene mycotoxin that is T-2 toxin in which the acetyloxy group at position 4S has been hydrolysed to the corresponding hydroxy group. It is the major metabolite of T-2 toxin. It has a role as a fungal metabolite and an apoptosis inducer. It is a trichothecene, an organic heterotetracyclic compound and an acetate ester. HT-2 Toxin is a natural product found in Fusarium heterosporum, Fusarium sporotrichioides, and other organisms with data available. A trichothecene mycotoxin that is T-2 toxin in which the acetyloxy group at position 4S has been hydrolysed to the corresponding hydroxy group. It is the major metabolite of T-2 toxin. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Nivalenol

(1S,2R,2R,3S,7R,9R,10R,11S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-4-one

C15H20O7 (312.1209)


Nivalenol is a trichothecene produced by Fusaria, Stachybotrys, Trichoderma and other fungi, and some higher plants. They may contaminate food or feed grains, induce emesis and hemorrhage in lungs and brain, and damage bone marrow due to protein and DNA synthesis inhibition.(PubChem). It has been reported in the urine of patients suffering chronic idiopathic spastic paraparesis. These patients are usually found in hot and humid regions, most of which have heavy rains, and these conditions allow foods to be polluted by fungi some of which become toxigenic (PubMed ID 8855894 ). Nivalenol is a trichothecene produced by Fusaria, Stachybotrys, Trichoderma and other fungi, and some higher plants. They may contaminate food or feed grains, induce emesis and hemorrhage in lungs and brain, and damage bone marrow due to protein and DNA synthesis inhibition.(PubChem) D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Rubrofusarin

InChI=1\C15H12O5\c1-7-3-10(16)14-12(20-7)5-8-4-9(19-2)6-11(17)13(8)15(14)18\h3-6,17-18H,1-2H

C15H12O5 (272.0685)


A member of the class of benzochromenones that is benzo[g]chromen-4-one carrying two additional hydroxy substituents at positions 5 and 6 as well as methyl and methoxy substituents at positions 2 and 8 respectively. An orange polyketide pigment that is a common intermediate in many different fungal biosynthetic pathways. CONFIDENCE Culture of Fusarium graminearum from DAOM

   

Dihydro-5-pentyl-2(3H)-furanone

(±)-Dihydro-5-pentyl-2(3H)-furanone

C9H16O2 (156.115)


Dihydro-5-pentyl-2(3H)-furanone is found in alcoholic beverages. Dihydro-5-pentyl-2(3H)-furanone is present in blackcurrant buds and berries, melon, papaya, pineapple, peaches, apricot, wheat bread, crispbread, wines, black tea and other foodstuffs. Dihydro-5-pentyl-2(3H)-furanone is a flavouring agent Flavouring ingredient. It is used in coconut flavours.

   

Ethyl acetate

Ethyl ester OF acetic acid

C4H8O2 (88.0524)


Ethyl acetate, also known as 1-acetoxyethane or acetic ester, belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). Ethyl acetate exists in all eukaryotes, ranging from yeast to humans. Ethyl acetate is a sweet, anise, and balsam tasting compound. Ethyl acetate is found, on average, in the highest concentration within a few different foods, such as milk (cow), pineapples, and sweet oranges and in a lower concentration in safflowers. Ethyl acetate has also been detected, but not quantified, in several different foods, such as alcoholic beverages, oxheart cabbages, agaves, chervils, ryes, and peach. It is used in artificial fruit essences. In the field of entomology, ethyl acetate is an effective asphyxiant for use in insect collecting and study. Because it is not hygroscopic, ethyl acetate also keeps the insect soft enough to allow proper mounting suitable for a collection. In a killing jar charged with ethyl acetate, the vapors will kill the collected (usually adult) insect quickly without destroying it. In organic and in natural products chemistry ethyl acetate is often used as a solvent for reactions or extractions. Ethyl acetate is a potentially toxic compound. Ethyl acetate, with regard to humans, has been found to be associated with several diseases such as perillyl alcohol administration for cancer treatment, crohns disease, nonalcoholic fatty liver disease, and pervasive developmental disorder not otherwise specified; ethyl acetate has also been linked to the inborn metabolic disorder celiac disease. Found in cereal crops, radishes, fruit juices, beer, wine, spirits etc. and produced by Anthemis nobilis (Roman chamomile) and Rubus subspecies It is used in artificial fruit essences. It is used as a solvent in the manufacture of modified hop extract and decaffeinated tea or coffeeand is also used for colour and inks used to mark fruit or vegetables

   

Trichodiene

[S-(R*,R*)]-1,4-Dimethyl-4-(1-methyl-2-methylenecyclopentyl)cyclohexene

C15H24 (204.1878)


   

Trichothecin

Trichothec-9-en-8-one, 12,13-epoxy-4-hydroxy-, crotonate

C19H24O5 (332.1624)


A trichothecene mycototoxin isolated from the endophytic fungus Trichothecium sp. and it exhibits anti-cancer properties. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

FA 11:1

((1S,2R)-2-Hexylcycloprop-1-yl)acetic acid

C11H20O2 (184.1463)


An undecenoic acid having its double bond in the 10-position. It is derived from castor oil and is used for the treatment of skin problems. D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use C254 - Anti-Infective Agent > C514 - Antifungal Agent Same as: D02159 10-Undecenoic acid is used as a starting agent in the synthesis of Pheromone (11Z)-hexadecenal. 10-Undecenoic acid is used as a starting agent in the synthesis of Pheromone (11Z)-hexadecenal.

   

4-Hydroxy-2-butenoic acid gamma-lactone

2-Butenoic acid, 4-hydroxy-, laquo gammaraquo -lactone

C4H4O2 (84.0211)


4-Hydroxy-2-butenoic acid gamma-lactone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D019440 - Anti-Obesity Agents > D001067 - Appetite Depressants 2(5H)-Furanone is an endogenous metabolite.

   

Fusarin C

Methyl (2Z,5Z,7E,9E)-11-[2,4-dihydroxy-4-(2-hydroxyethyl)-6-oxa-3-azabicyclo[3.1.0]hex-2-en-1-yl]-2-ethylidene-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoic acid

C23H29NO7 (431.1944)


Fusarin C is produced by many Fusarium species in infected corn. Production by many Fusarium subspecies in infected corn. D009676 - Noxae > D009153 - Mutagens

   

Taleranol

beta-Zearalanol

C18H26O5 (322.178)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins Beta-Zearalenol is an mycotoxin produced by Fusarium spp, which causes apoptosis and oxidative stress in mammalian reproductive cells[1]. Beta-Zearalenol is the derivative of zearalenone (ZEA) which can conjugate with glucuronic acid[2].

   

Gamma-Caprolactone

gamma-Ethyl-gamma-butyrolactone, gamma-Caprolactone

C6H10O2 (114.0681)


Gamma-Caprolactone, also known as 4-ethyl-4-butanolide or 4-hexanolide, belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Thus, Gamma-caprolactone is considered to be a fatty ester lipid molecule. Gamma-Caprolactone is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Gamma-Caprolactone exists in all eukaryotes, ranging from yeast to humans. Outside of the human body, Gamma-caprolactone has been detected, but not quantified in several different foods, such as potato, cereals and cereal products, pomes, alcoholic beverages, and fruits. It is occasionally found as a volatile component of human urine. In some cases differences up to an order of magnitude are observed. It has been also found in the polar fraction of human blood. Gamma-caprolactone is a gamma-lactone that is oxolan-2-one substituted by an ethyl group at position 5. It has a role as a human blood serum metabolite. gamma-Caprolactone is a natural product found in Psidium guajava, Polygala senega, and other organisms with data available. 4-Hexanolide is a metabolite found in or produced by Saccharomyces cerevisiae. A gamma-lactone that is oxolan-2-one substituted by an ethyl group at position 5. γ-Hexalactone is a gamma-lactone found in ripe fruits. γ-Hexalactone induces DNA damage and acts a substrate of paraoxonase 1 (PON1)[1][2][3]. γ-Hexalactone is a gamma-lactone found in ripe fruits. γ-Hexalactone induces DNA damage and acts a substrate of paraoxonase 1 (PON1)[1][2][3].

   

delta-Decalactone

delta-Decanolactone, (+/-)-delta-Pentyl-delta-valerolactone

C10H18O2 (170.1307)


delta-Decalactone, also known as 5-decanolide or δ-amylvalerolactone, belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety. Thus, delta-decalactone is considered to be a fatty ester lipid molecule. delta-Decalactone is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. delta-Decalactone is a sweet, apricot, and butter tasting compound. delta-Decalactone has been detected, but not quantified, in several different foods, such as coconuts, evergreen blackberries, bilberries, milk and milk products, and fats and oils. This could make delta-decalactone a potential biomarker for the consumption of these foods. A delta-lactone that is 5-valerolactone substituted by a pentyl group at position 6. 6-pentyloxan-2-one is a delta-lactone that is 5-valerolactone substituted by a pentyl group at position 6. It has a role as a metabolite. It is functionally related to a 5-valerolactone. delta-Decalactone is a natural product found in Curio articulatus, Mangifera indica, and Fusarium poae with data available. 1,5-Decanolide is a metabolite found in or produced by Saccharomyces cerevisiae. Present in coconut oil, butter oil, apricots, peaches, cheese, cane sugar, pork fat, margarine, lavender oil, and other substances. Fragrance raw material and flavouring agent. 5-Pentyl-delta-valerolactone is found in many foods, some of which are bilberry, fruits, animal foods, and milk and milk products. A delta-lactone that is 5-valerolactone substituted by a pentyl group at position 6. δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2]. δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2].

   

15-Acetyl-4-deoxynivalenol

{3,10-dihydroxy-1,5-dimethyl-4-oxo-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-2-yl}methyl acetic acid

C17H22O7 (338.1365)


15-Acetyl-4-deoxynivalenol is a mycotoxin produced by Fusarium graminearum and Gibberella zeae.

   

xi-5-Hexyldihydro-2(3H)-furanone

4-Hydroxydecanoic acid gamma-lactone

C10H18O2 (170.1307)


xi-5-Hexyldihydro-2(3H)-furanone, also known as 4-hexyl-4-butanolide or gamma-lactone decanoic acid, belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a carboxy group on the carbon adjacent to the oxygen atom. xi-5-Hexyldihydro-2(3H)-furanone has been detected, but not quantified, in fruits. This could make XI-5-hexyldihydro-2(3H)-furanone a potential biomarker for the consumption of these foods. Component of apricot, plum and strawberry aromas. xi-5-Hexyldihydro-2(3H)-furanone is found in fruits.

   

Acetyldeoxynivalenol

3-Hydroxy-2-(hydroxymethyl)-1,5-dimethyl-4-oxo-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-10-yl acetic acid

C17H22O7 (338.1365)


Toxin from infected barley. Acetyldeoxynivalenol is found in cereals and cereal products. Acetyldeoxynivalenol is found in cereals and cereal products. Toxin from infected barle D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

2-Methylfuran

2-Methylfuran (acd/name 4.0)

C5H6O (82.0419)


2-Methylfuran is a flammable, water-soluble liquid with a chocolate odor, found naturally in Myrtle and Dutch Lavender used as a FEMA GRAS (Generally Recognized As Safe) flavoring substance, with the potential for use in alternative fuels. Maillard product

   

Monoacetoxyscirpenol

{10,11-dihydroxy-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-2-yl}methyl acetic acid

C17H24O6 (324.1573)


Monoacetoxyscirpenol is a mycotoxin from Fusarium roseum and Fusarium sulphureu D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

4,8-Diacetyl-T2-tetrol

4-(Acetyloxy)-10-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0²,⁷]dodecan]-5-en-11-yl acetic acid

C19H26O8 (382.1628)


4,8-Diacetyl-T2-tetrol is a mycotoxin produced by Fusarium sporotrichioides, Fusarium tricinctum and Haemophilus parainfluenzae. Mycotoxin production by Fusarium sporotrichioides, Fusarium tricinctum and Haemophilus parainfluenzae D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Dihydro-5-propyl-2(3H)-furanone

4-Propyl-4-hydroxybutanoic acid lactone

C7H12O2 (128.0837)


xi-Dihydro-5-propyl-2(3H)-furanone is found in alcoholic beverages. xi-Dihydro-5-propyl-2(3H)-furanone is present in papaya, peach, pineapple, mango, nectarine, cape gooseberry, asparagus, licorice, black tea, wines and canned beef. Flavouring agent [DFC]. 4-Propyl-gamma-butyrolactone is found in peach.

   

Dihydro-5-methyl-2(3H)-furanone

4-Methyl-4-hydroxybutanoic acid lactone

C5H8O2 (100.0524)


Dihydro-5-methyl-2(3H)-furanone, also known as 4-hydroxypentanoic acid lactone or 4-methyl-gamma-butyrolactone, belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Thus, dihydro-5-methyl-2(3H)-furanone is considered to be a fatty ester lipid molecule. Dihydro-5-methyl-2(3H)-furanone is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Constituent of crude pyroligneous acid. It is used in smoke flavours.

   

Toxin FS2

4-[4-hydroxy-2-(hydroxymethyl)-1-methylcyclopent-2-en-1-yl]-1,4-dimethylcyclohex-2-en-1-ol

C15H24O3 (252.1725)


D009676 - Noxae > D011042 - Poisons > D014688 - Venoms Epi FS2 is from Fusarium sporotrichioides. Isolated from Fusarium sporotrichioides

   

Sporol

[3S-(3alpha,4abeta,5aalpha,7b,8aalpha,8balpha)]-Hexahydro-3,8a-dimethyl-4a,7-Epoxy-3,8b-ethano-1H,5aH-cyclopenta[4,5]furo[3,2-c]pyran-5a-methanol

C15H22O4 (266.1518)


Sporol is a mycotoxin from Fusarium sporotrichioides MC-72083. Mycotoxin from Fusarium sporotrichioides MC-72083

   

7(14)-Bisabolene-2,3,10,11-tetrol

4-(5,6-dihydroxy-6-methylhept-1-en-2-yl)-1-methylcyclohexane-1,2-diol

C15H28O4 (272.1987)


7(14)-Bisabolene-2,3,10,11-tetrol is a mycotoxin of Fusarium sambucinu Mycotoxin of Fusarium sambucinum

   

Fusarochromanone

5-amino-6-(3-amino-4-Hydroxy-1-oxobutyl)-2,3-dihydro-2,2-dimethyl-4H-1-benzopyran-4-one, 9ci

C15H20N2O4 (292.1423)


Fusarochromanone is found in animal foods. Fusarochromanone is a mycotoxin produced by Fusarium roseum and the cereal fungus Fusarium equiseti (Fusarium graminearum). Affects growth and development of poultry. Mycotoxin production by Fusarium roseum and the cereal fungus Fusarium equiseti (Fusarium graminearum). Affects growth and development of poultry. Fusarochromanone is found in animal foods.

   

FS4 toxin

4-(4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl)-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

C15H22O3 (250.1569)


FS4 toxin is from Fusarium sporotrichioides and Fusarium sambucinum. From Fusarium sporotrichioides and Fusarium sambucinum

   

4-Butyl-gamma-butyrolactone

4-Butyl-4-hydroxybutyric acid lactone

C8H14O2 (142.0994)


Present in apricots, peaches and other fruits. Flavouring ingredient [DFC]. 4-Butyl-gamma-butyrolactone is found in many foods, some of which are peach, bilberry, papaya, and pineapple. 4-Butyl-gamma-butyrolactone is found in bilberry. 4-Butyl-gamma-butyrolactone is present in apricots, peaches and other fruits. 4-Butyl-gamma-butyrolactone is a flavouring ingredien

   

Sambucinol

(1R,6R,7R,9S,10R,11R)-11-(hydroxymethyl)-3,6,7-trimethyl-12,13-dioxatetracyclo[8.2.1.01,6.07,11]tridec-2-en-9-ol

C15H22O4 (266.1518)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

   

Trichotriol

[3S-[3lphaa,4beta,5beta,7beta(1R*,4S*)]]-7-(4-Hydroxy-1,4-dimethyl-2-cyclohexen-1-yl)-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol

C15H24O4 (268.1675)


   

Cyclonerotriol

Cyclonerotriol

C15H28O3 (256.2038)


   

3,15-Diacetyldeoxynivalenol

3,15-Bis(acetyloxy)-12,13-epoxy-7-hydroxytrichothec-9-en-8-one (3alpha)-

C19H24O8 (380.1471)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

   

Aurofusarin

5-hydroxy-7-(5-hydroxy-8-methoxy-2-methyl-4,6,9-trioxobenzo[g]chromen-7-yl)-8-methoxy-2-methylbenzo[g]chromene-4,6,9-trione

C30H18O12 (570.0798)


CONFIDENCE Culture of Fusarium graminearum from DAOM

   

2-Pyruvoylaminobenzamide

2-Pyruvoylaminobenzamide

C10H10N2O3 (206.0691)


   

Sporol

[3S-(3alpha,4abeta,5aalpha,7b,8aalpha,8balpha)]-Hexahydro-3,8a-dimethyl-4a,7-Epoxy-3,8b-ethano-1H,5aH-cyclopenta[4,5]furo[3,2-c]pyran-5a-methanol

C15H22O4 (266.1518)


   

4-Methyl-4-(1-methyl-2-methylenecyclopentyl)cyclohexene-1-methanol

4-Methyl-4-(1-methyl-2-methylenecyclopentyl)cyclohexene-1-methanol

C15H24O (220.1827)


   

15ADON

[(1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl]methyl acetate

C17H22O7 (338.1365)


15-acetyldeoxynivalenol is a trichothecene mycotoxin that is deoxynivalenol acetylated on the oxygen at C-15. A skin and eye irritant, along with its 3-acetyl regioisomer and its parent deoxynivalenol it is considered among the most commonly and widely distributed cereal contaminants. It has a role as an epitope and a mycotoxin. It is functionally related to a deoxynivalenol. 15-Acetyldeoxynivalenol is a natural product found in Fusarium culmorum and Fusarium graminearum with data available. A trichothecene mycotoxin that is deoxynivalenol acetylated on the oxygen at C-15. A skin and eye irritant, along with its 3-acetyl regioisomer and its parent deoxynivalenol it is considered among the most commonly and widely distributed cereal contaminants. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

δ-Decalactone

delta-Decalactone

C10H18O2 (170.1307)


[Raw Data] CB015_delta-Decalactone_pos_20eV_CB000009.txt [Raw Data] CB015_delta-Decalactone_pos_10eV_CB000009.txt δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2]. δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2].

   

UNII:7HLS05KP9O

4-Hexyl-gamma-butyrolactone

C10H18O2 (170.1307)


Xi-5-hexyldihydro-2(3h)-furanone, also known as 4-decanolide or gamma-decanolactone, is a member of the class of compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Xi-5-hexyldihydro-2(3h)-furanone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Xi-5-hexyldihydro-2(3h)-furanone can be found in fruits, which makes xi-5-hexyldihydro-2(3h)-furanone a potential biomarker for the consumption of this food product. [Raw Data] CB016_gamma-Decalactone_pos_20eV_CB000010.txt [Raw Data] CB016_gamma-Decalactone_pos_10eV_CB000010.txt

   

Zearalenone

(4S,12E)-16,18-dihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione

C18H22O5 (318.1467)


A macrolide comprising a fourteen-membered lactone fused to 1,3-dihydroxybenzene; a potent estrogenic metabolite produced by some Giberella species. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE standard compound; INTERNAL_ID 5970 Origin: Microbe; Formula(Parent): C18H22O5; Bottle Name:zearalenone; PRIME Parent Name:Zearalenone; PRIME in-house No.:V0033 CONFIDENCE Reference Standard (Level 1) Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2]. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2].

   

Beauvericin

NCGC00380798-01_C45H57N3O9_(3S,6R,9S,12R,15S,18R)-3,9,15-Tribenzyl-6,12,18-triisopropyl-4,10,16-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone

C45H57N3O9 (783.4095)


A trimeric cyclodepsipeptide composed from alternating methylphenylalanyl and hydroxyvaleryl residues. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C259 - Antineoplastic Antibiotic CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2334 CONFIDENCE Reference Standard (Level 1) Beauvericin is a Fusarium mycotoxin. Beauvericin inhibits acyl-CoA: cholesterol acyltransferase (ACAT) activity with an IC50 of 3 μM in an enzyme assay using rat liver microsomes[1]. Beauvericin is a Fusarium mycotoxin. Beauvericin inhibits acyl-CoA: cholesterol acyltransferase (ACAT) activity with an IC50 of 3 μM in an enzyme assay using rat liver microsomes[1].

   

Moniliformin

Moniliformin

C4H2O3 (98.0004)


   

Diacetoxyscirpenol

4,15-Diacetoxyscirpenol

C19H26O7 (366.1678)


   

HT-2 Toxin

[(1S,2R,4S,7R,9R,10R,11S,12S)-2-(acetyloxymethyl)-10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate

C22H32O8 (424.2097)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)

   

DEOXYNIVALENOL

(1R,2R,3S,7R,9R,10R,12S)-3,10-dihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-one

C15H20O6 (296.126)


A trichothecene mycotoxin produced by Fusarium to which wheat, barley, maize (corn) and their products are susceptible to contamination. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

   

15-Acetyldeoxynivalenol

15-Acetyl-deoxynivalenol

C17H22O7 (338.1365)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)

   

CID 440908

(1S,2R,3S,10R,11S)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-4-one

C15H20O7 (312.1209)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)

   

Vomitoxin

DEOXYNIVALENOL

C15H20O6 (296.126)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE standard compound; INTERNAL_ID 5967

   

Fusarenon-X

CID 12309986

C17H22O8 (354.1315)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Sylvan

5-17-01-00322 (Beilstein Handbook Reference)

C5H6O (82.0419)


   

Heptan-4-olide

4-Propyl-4-hydroxybutanoic acid lactone

C7H12O2 (128.0837)


   

15-Acetylvomitoxin

3,10-dihydroxy-1,5-dimethyl-4-oxo-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-2-ylmethyl acetate

C17H22O7 (338.1365)


   

Isotrichodermin

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-10-yl acetate

C17H24O4 (292.1675)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Toxin T1

4-(acetyloxy)-10-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-11-yl acetate

C19H26O8 (382.1628)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

4-Octanolide

4-Butyl-4-hydroxybutyric acid lactone

C8H14O2 (142.0994)


   

Isotrichodermol

1,2,5-trimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-10-ol

C15H22O3 (250.1569)


A trichothecene mycotoxin produced by Fusarium graminearum. It is a biosynthetic precursor in the synthesis of T2-toxin.

   

Deacetylanguidin

10,11-dihydroxy-1,5-dimethyl-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-2-ylmethyl acetate

C17H24O6 (324.1573)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

7(14)-Bisabolene-2,3,10,11-tetrol

4-(5,6-dihydroxy-6-methylhept-1-en-2-yl)-1-methylcyclohexane-1,2-diol

C15H28O4 (272.1987)


   

3-Acetyl DON

3-hydroxy-2-(hydroxymethyl)-1,5-dimethyl-4-oxo-8-oxaspiro[oxirane-2,12-tricyclo[7.2.1.0^{2,7}]dodecan]-5-en-10-yl acetate

C17H22O7 (338.1365)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

FS2 Toxin

4-[4-hydroxy-2-(hydroxymethyl)-1-methylcyclopent-2-en-1-yl]-1,4-dimethylcyclohex-2-en-1-ol

C15H24O3 (252.1725)


   

FS4 toxin

4-(4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl)-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

C15H22O3 (250.1569)


   

5-Decanolide

Decanoic acid, 5-hydroxy-, laquo deltaRaquo -lactone

C10H18O2 (170.1307)


δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2]. δ-Decalactone is a lactone compound found in nonfat dry milks and fruit. δ-Decalactone has a sweet taste[1][2].

   

4-Acetylzearalenone

16-hydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-14-yl acetate

C20H24O6 (360.1573)


   

FA 5:1

(Z)-2-pentenoic acid;C5:1, n-3 cis;Pent-2c-ensaeure;Z-2-Pentencarbonsaeure;cis-2-pentenoic acid;cis-Pent-2-ensaeure;cis-alpha,beta-penteneoic acid;cis-beta-Aethylacrylsaeure;pent-2c-enoic acid

C5H8O2 (100.0524)


   

gamma-Valerolactone

(S)-gamma-valerolactone

C5H8O2 (100.0524)


   

Trichothec-9-ene-3,15-diol, 12,13-epoxy-, 15-acetate, (3alpha)-

Trichothec-9-ene-3,15-diol, 12,13-epoxy-, 15-acetate, (3alpha)-

C19H26O6 (350.1729)


   

Acetidin

Ethyl acetate [UN1173] [Flammable liquid]

C4H8O2 (88.0524)


   

Gamma-Caprolactone

4-ethylbutanolide (gamma-hexalactone)

C6H10O2 (114.0681)


Gamma-Caprolactone, also known as 4-ethyl-4-butanolide or 4-hexanolide, belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Thus, Gamma-caprolactone is considered to be a fatty ester lipid molecule. Gamma-Caprolactone is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Gamma-Caprolactone exists in all eukaryotes, ranging from yeast to humans. Outside of the human body, Gamma-caprolactone has been detected, but not quantified in several different foods, such as potato, cereals and cereal products, pomes, alcoholic beverages, and fruits. It is occasionally found as a volatile component of human urine. In some cases differences up to an order of magnitude are observed. It has been also found in the polar fraction of human blood. Constituent of fruits, e.g. apple, raspberry, strawberry, wine grapes, quince etcand is) also present in French fried potato, wheat bread, crispbread, butter, red or white wine and cooked beef. xi-5-Ethyldihydro-2(3H)-furanone is found in many foods, some of which are animal foods, fruits, pomes, and potato. γ-Hexalactone is a gamma-lactone found in ripe fruits. γ-Hexalactone induces DNA damage and acts a substrate of paraoxonase 1 (PON1)[1][2][3]. γ-Hexalactone is a gamma-lactone found in ripe fruits. γ-Hexalactone induces DNA damage and acts a substrate of paraoxonase 1 (PON1)[1][2][3].

   

T-2 Mycotoxin

T-2 Mycotoxin

C24H34O9 (466.2203)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

8-Hydroxydiacetoxyscirpenol

8-Hydroxydiacetoxyscirpenol

C19H26O8 (382.1628)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

[(1R,2R,10R)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-10-yl] acetate

[(1R,2R,10R)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-10-yl] acetate

C17H24O5 (308.1624)


   

ETHYL ACETATE

ETHYL ACETATE

C4H8O2 (88.0524)


The acetate ester formed between acetic acid and ethanol.

   

2(5H)-Furanone

2H-furan-5-one

C4H4O2 (84.0211)


D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D019440 - Anti-Obesity Agents > D001067 - Appetite Depressants 2(5H)-Furanone is an endogenous metabolite.

   

Fusarin C

Fusarin C

C23H29NO7 (431.1944)


D009676 - Noxae > D009153 - Mutagens

   

γ-Valerolactone

gamma-Valerolactone

C5H8O2 (100.0524)


A butan-4-olide that is dihydrofuran-2(3H)-one substituted by a methyl group at position 5. It has been found in the urine samples of humans exposed to n-hexane.

   

4-Undecanolide

Gamma-undecalactone

C11H20O2 (184.1463)


   

2-METHYLFURAN

2-METHYLFURAN

C5H6O (82.0419)


A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a methyl group.

   

gamma-Heptalactone

5-Propyldihydro-2(3H)-furanone

C7H12O2 (128.0837)


   

GAMMA-OCTALACTONE

5-Butyldihydro-2(3H)-furanone

C8H14O2 (142.0994)


A gamma-lactone that is oxolan-2-one substituted by a butyl group at position 5. It is a volatile compound found in peaches, mangoes, beef and ham.

   

Desacetylanguidine

(10,11-dihydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-2-yl)methyl acetate

C17H24O6 (324.1573)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

Acetyldeoxynivalenol

Acetyldeoxynivalenol

C17H22O7 (338.1365)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

15-Acetyl-4-deoxynivalenol

15-Acetyl-4-deoxynivalenol

C17H22O7 (338.1365)


   

Fusarochromanone

Fusarochromanone

C15H20N2O4 (292.1423)


   

Toxin FS2

Toxin FS2

C15H24O3 (252.1725)


D009676 - Noxae > D011042 - Poisons > D014688 - Venoms

   

4,8-Diacetyl-T2-tetrol

4,8-Diacetyl-T2-tetrol

C19H26O8 (382.1628)


D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

3',4'-dihydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-yl acetate

3',4'-dihydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-yl acetate

C17H24O7 (340.1522)


   

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-6-{[(2e,4z)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[(2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-6-{[(2e,4z)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[(2s,3r,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

C51H74O21 (1022.4722)


   

(1's,2r,2'r,7'r,9'r,11'r)-1',2',5'-trimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl (2z)-but-2-enoate

(1's,2r,2'r,7'r,9'r,11'r)-1',2',5'-trimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl (2z)-but-2-enoate

C19H24O5 (332.1624)


   

2-(2-oxopropanamido)benzenecarboximidic acid

2-(2-oxopropanamido)benzenecarboximidic acid

C10H10N2O3 (206.0691)


   

2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol

2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol

C15H26O3 (254.1882)


   

(4r)-4-[(1s,4s)-4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl]-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

(4r)-4-[(1s,4s)-4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl]-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

C15H22O3 (250.1569)


   

(2r,3s,4e,6e)-7-[(1ar,2r,3s,3as,7ar,7bs)-2-[(2e)-but-2-en-2-yl]-1a,6-dimethyl-2h,3h,3ah,4h,7h,7ah,7bh-naphtho[1,2-b]oxiren-3-yl]-3-hydroxy-2,4-dimethylhepta-4,6-dienoic acid

(2r,3s,4e,6e)-7-[(1ar,2r,3s,3as,7ar,7bs)-2-[(2e)-but-2-en-2-yl]-1a,6-dimethyl-2h,3h,3ah,4h,7h,7ah,7bh-naphtho[1,2-b]oxiren-3-yl]-3-hydroxy-2,4-dimethylhepta-4,6-dienoic acid

C25H36O4 (400.2613)


   

β-zearalanol

β-zearalanol

C18H26O5 (322.178)


   

(1's,2's,3'r,7's,9's,10's)-10'-acetyl-3'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-one

(1's,2's,3'r,7's,9's,10's)-10'-acetyl-3'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-one

C17H22O6 (322.1416)


   

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

C41H60O20 (872.3678)


   

3-[(6-{[(2e)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl 7-hydroxyhexadeca-2,4,8,10-tetraenoate

3-[(6-{[(2e)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl 7-hydroxyhexadeca-2,4,8,10-tetraenoate

C51H74O21 (1022.4722)


   

(1r,2r,6r,8s)-6-(hydroxymethyl)-1,2,10-trimethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-one

(1r,2r,6r,8s)-6-(hydroxymethyl)-1,2,10-trimethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-one

C15H22O3 (250.1569)


   

(3s,4r,5r,7r)-7-[(1s,4r)-4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl]-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol

(3s,4r,5r,7r)-7-[(1s,4r)-4-hydroxy-1,4-dimethylcyclohex-2-en-1-yl]-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol

C15H24O4 (268.1675)


   

1-(4-hydroxyquinazolin-2-yl)ethanone

1-(4-hydroxyquinazolin-2-yl)ethanone

C10H8N2O2 (188.0586)


   

3'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-yl acetate

3'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-yl acetate

C17H22O7 (338.1365)


   

(1s,2s,5r,7r,8r,9s,11r)-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol

(1s,2s,5r,7r,8r,9s,11r)-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol

C15H26O3 (254.1882)


   

2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-3',4',10'-triol

2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-3',4',10'-triol

C15H22O6 (298.1416)


   

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl hexanoate

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl hexanoate

C25H36O9 (480.2359)


   

1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-ene-4,6-diol

1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-ene-4,6-diol

C15H24O3 (252.1725)


   

(1s,2r,5r,6r,7s)-5-hydroxy-6,7,10-trimethyltricyclo[5.3.1.0²,⁶]undec-9-ene-2-carboxylic acid

(1s,2r,5r,6r,7s)-5-hydroxy-6,7,10-trimethyltricyclo[5.3.1.0²,⁶]undec-9-ene-2-carboxylic acid

C15H22O3 (250.1569)


   

6-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-5-one

6-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-5-one

C15H22O3 (250.1569)


   

2,9-dimethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

2,9-dimethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

C13H22O2 (210.162)


   

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl pentanoate

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl pentanoate

C24H34O9 (466.2203)


   

(1's,2s,2'r,3's,7'r,9'r,10'r,11's)-3',10'-dihydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

(1's,2s,2'r,3's,7'r,9'r,10'r,11's)-3',10'-dihydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

C17H22O8 (354.1315)


   

4,12,13-trihydroxy-9-(hydroxymethyl)-6,10-dimethyl-3,14-dioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,⁹]tetradecan-5-one

4,12,13-trihydroxy-9-(hydroxymethyl)-6,10-dimethyl-3,14-dioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,⁹]tetradecan-5-one

C15H22O7 (314.1365)


   

beauvericin

NA

C45H57N3O9 (783.4095)


{"Ingredient_id": "HBIN017671","Ingredient_name": "beauvericin","Alias": "NA","Ingredient_formula": "C45H57N3O9","Ingredient_Smile": "CC(C)C1C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(=O)O1)CC2=CC=CC=C2)C)C(C)C)CC3=CC=CC=C3)C)C(C)C)CC4=CC=CC=C4)C","Ingredient_weight": "783.9 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2188","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44419427","DrugBank_id": "NA"}

   

(1'r,2'r,10'r)-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-ol

(1'r,2'r,10'r)-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-10'-ol

C15H22O3 (250.1569)


   

methyl (2e,3e,5e,7e,9e)-11-[(1s,4s,5r)-2,4-dihydroxy-4-(2-hydroxyethyl)-6-oxa-3-azabicyclo[3.1.0]hex-2-en-1-yl]-2-ethylidene-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoate

methyl (2e,3e,5e,7e,9e)-11-[(1s,4s,5r)-2,4-dihydroxy-4-(2-hydroxyethyl)-6-oxa-3-azabicyclo[3.1.0]hex-2-en-1-yl]-2-ethylidene-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoate

C23H29NO7 (431.1944)


   

(2'r,4's,7'r,10'r,11's)-2'-[(acetyloxy)methyl]-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

(2'r,4's,7'r,10'r,11's)-2'-[(acetyloxy)methyl]-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

C22H32O8 (424.2097)


   

3'-hydroxy t-2 toxin

3'-hydroxy t-2 toxin

C24H34O10 (482.2152)


   

(1r,2s,7s,8s,9r,11r)-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

(1r,2s,7s,8s,9r,11r)-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

C15H26O2 (238.1933)


   

(1r,2s,7s,8s,9r)-8-hydroxy-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecan-11-one

(1r,2s,7s,8s,9r)-8-hydroxy-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecan-11-one

C15H24O2 (236.1776)


   

(2r,3r,4s,5s,6s)-3-{[(2s,3r,4s,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,7s,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

(2r,3r,4s,5s,6s)-3-{[(2s,3r,4s,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,7s,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

C41H60O20 (872.3678)


   

(1's,2'r,4's,7'r,9'r,10'r,11's)-10',11'-bis(acetyloxy)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

(1's,2'r,4's,7'r,9'r,10'r,11's)-10',11'-bis(acetyloxy)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

C24H34O9 (466.2203)


   

(1'r,2s,2'r,7'r,9'r,10'r,11's)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-10',11'-diol

(1'r,2s,2'r,7'r,9'r,10'r,11's)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-10',11'-diol

C15H22O5 (282.1467)


   

(1r,2r,4r,6s,9r)-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-ene-4,6-diol

(1r,2r,4r,6s,9r)-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-ene-4,6-diol

C15H24O3 (252.1725)


   

(2'r,4's,10'r,11's)-11'-(acetyloxy)-4',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

(2'r,4's,10'r,11's)-11'-(acetyloxy)-4',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C19H26O8 (382.1628)


   

(1r,4r)-4-[(1s,4r)-4-hydroxy-2-(hydroxymethyl)-1-methylcyclopent-2-en-1-yl]-1,4-dimethylcyclohex-2-en-1-ol

(1r,4r)-4-[(1s,4r)-4-hydroxy-2-(hydroxymethyl)-1-methylcyclopent-2-en-1-yl]-1,4-dimethylcyclohex-2-en-1-ol

C15H24O3 (252.1725)


   

4'-(acetyloxy)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

4'-(acetyloxy)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

C19H26O8 (382.1628)


   

(1's,2s,2'r,4's,7'r,9'r,10'r,11's)-10'-(acetyloxy)-2'-[(acetyloxy)methyl]-11'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

(1's,2s,2'r,4's,7'r,9'r,10'r,11's)-10'-(acetyloxy)-2'-[(acetyloxy)methyl]-11'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

C24H34O9 (466.2203)


   

[4-methyl-4-(1-methyl-2-methylidenecyclopentyl)cyclohex-1-en-1-yl]methanol

[4-methyl-4-(1-methyl-2-methylidenecyclopentyl)cyclohex-1-en-1-yl]methanol

C15H24O (220.1827)


   

(2'r,7'r,9'r,10'r,11's)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

(2'r,7'r,9'r,10'r,11's)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

C17H24O6 (324.1573)


   

3-[(2s,5r,6r)-6-[(2e)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-4-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-2-one

3-[(2s,5r,6r)-6-[(2e)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-4-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-2-one

C28H39NO4 (453.2879)


   

(1's,2s,2'r,7'r,9'r,10'r,11's)-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

(1's,2s,2'r,7'r,9'r,10'r,11's)-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C17H24O6 (324.1573)


   

(1r,2r,4s,6r,8s)-1,2,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

(1r,2r,4s,6r,8s)-1,2,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

C15H24O2 (236.1776)


   

4-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-6-yl acetate

4-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-6-yl acetate

C17H26O4 (294.1831)


   

(1r,2r,4r,6r,8s)-6-(hydroxymethyl)-1,2,10-trimethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

(1r,2r,4r,6r,8s)-6-(hydroxymethyl)-1,2,10-trimethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

C15H24O3 (252.1725)


   

[(4s)-4-methyl-4-[(1s)-1-methyl-2-methylidenecyclopentyl]cyclohex-1-en-1-yl]methanol

[(4s)-4-methyl-4-[(1s)-1-methyl-2-methylidenecyclopentyl]cyclohex-1-en-1-yl]methanol

C15H24O (220.1827)


   

9-(hydroxymethyl)-2,6,6-trimethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

9-(hydroxymethyl)-2,6,6-trimethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol

C15H26O3 (254.1882)


   

(2r,3s,4e,6e)-7-[(1s,2r,3r,4ar,8as)-2-[(2e)-but-2-en-2-yl]-3-hydroxy-3,6-dimethyl-4-oxo-1,2,4a,5,8,8a-hexahydronaphthalen-1-yl]-3-hydroxy-2,4-dimethylhepta-4,6-dienoic acid

(2r,3s,4e,6e)-7-[(1s,2r,3r,4ar,8as)-2-[(2e)-but-2-en-2-yl]-3-hydroxy-3,6-dimethyl-4-oxo-1,2,4a,5,8,8a-hexahydronaphthalen-1-yl]-3-hydroxy-2,4-dimethylhepta-4,6-dienoic acid

C25H36O5 (416.2563)


   

(1'r,2s,2'r,4's,7'r,9'r,10'r,11's)-4'-(acetyloxy)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

(1'r,2s,2'r,4's,7'r,9'r,10'r,11's)-4'-(acetyloxy)-10'-hydroxy-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl acetate

C19H26O8 (382.1628)


   

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-6-{[(2e,4z)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

(2r,3r,4r,5s,6s)-3-{[(2s,3r,4s,5r,6r)-6-{[(2e,4z)-deca-2,4-dienoyloxy]methyl}-4,5-dihydroxy-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

C51H74O21 (1022.4722)


   

11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

11'-(acetyloxy)-10'-hydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C19H24O8 (380.1471)


   

(1s,2s,6s,7r,8r,9s)-8-hydroxy-6-(hydroxymethyl)-2,6,9-trimethyltricyclo[5.4.0.0²,⁹]undecan-11-one

(1s,2s,6s,7r,8r,9s)-8-hydroxy-6-(hydroxymethyl)-2,6,9-trimethyltricyclo[5.4.0.0²,⁹]undecan-11-one

C15H24O3 (252.1725)


   

3-[(2s,5r,6r)-6-[(2e,4r,6s)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-2-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-4-one

3-[(2s,5r,6r)-6-[(2e,4r,6s)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-2-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-4-one

C28H39NO4 (453.2879)


   

11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl pentanoate

11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl pentanoate

C24H34O9 (466.2203)


   

1,4-dimethyl-4-(1-methyl-2-methylidenecyclopentyl)cyclohex-1-ene

1,4-dimethyl-4-(1-methyl-2-methylidenecyclopentyl)cyclohex-1-ene

C15H24 (204.1878)


   

(2r,3r,4s,5s,6s)-3-{[(2s,3s,4s,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,7s,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

(2r,3r,4s,5s,6s)-3-{[(2s,3s,4s,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-6-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-hydroxy-2-(hydroxymethyl)oxan-4-yl (2e,4e,7s,8e,10e)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

C41H60O20 (872.3678)


   

3-[16-amino-3,6,9,12,15,27-hexahydroxy-10-(hydroxymethyl)-13-(2-methylpropyl)-4-octyl-19,21-dioxo-20-oxa-24,25-dithia-2,5,8,11,14,28-hexaazabicyclo[20.4.2]octacosa-2,5,8,11,14,27-hexaen-7-yl]-2-hydroxypropanimidic acid

3-[16-amino-3,6,9,12,15,27-hexahydroxy-10-(hydroxymethyl)-13-(2-methylpropyl)-4-octyl-19,21-dioxo-20-oxa-24,25-dithia-2,5,8,11,14,28-hexaazabicyclo[20.4.2]octacosa-2,5,8,11,14,27-hexaen-7-yl]-2-hydroxypropanimidic acid

C35H58N8O12S2 (846.3615)


   

5-hydroxy-6,7,10-trimethyltricyclo[5.3.1.0²,⁶]undec-9-ene-2-carboxylic acid

5-hydroxy-6,7,10-trimethyltricyclo[5.3.1.0²,⁶]undec-9-ene-2-carboxylic acid

C15H22O3 (250.1569)


   

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl propanoate

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-2'-[(acetyloxy)methyl]-10'-hydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl propanoate

C22H30O9 (438.189)


   
   

(1's,2s,2'r,3's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-3',10'-dihydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

(1's,2s,2'r,3's,7'r,9'r,10'r,11's)-11'-(acetyloxy)-3',10'-dihydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C19H24O9 (396.142)


   

(6r)-6-[(1s)-2-(hydroxymethyl)-1-methyl-4-oxocyclopent-2-en-1-yl]-3,6-dimethylcyclohex-2-en-1-one

(6r)-6-[(1s)-2-(hydroxymethyl)-1-methyl-4-oxocyclopent-2-en-1-yl]-3,6-dimethylcyclohex-2-en-1-one

C15H20O3 (248.1412)


   

10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C17H24O6 (324.1573)


   

(3s,11z)-16-hydroxy-3-methyl-1,7-dioxo-4,5,6,8,9,10-hexahydro-3h-2-benzoxacyclotetradecin-14-yl acetate

(3s,11z)-16-hydroxy-3-methyl-1,7-dioxo-4,5,6,8,9,10-hexahydro-3h-2-benzoxacyclotetradecin-14-yl acetate

C20H24O6 (360.1573)


   

(1'r,2r,2's,4'r,9's,10's,11'r)-11'-(acetyloxy)-4',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

(1'r,2r,2's,4'r,9's,10's,11'r)-11'-(acetyloxy)-4',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C19H26O8 (382.1628)


   

(1'r,2'r,3'r,7'r,10'r)-3',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

(1'r,2'r,3'r,7'r,10'r)-3',10'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C17H24O6 (324.1573)


   

(1'r,2s,2'r,9'r,10'r,11's)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-10',11'-diol

(1'r,2s,2'r,9'r,10'r,11's)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-10',11'-diol

C15H22O5 (282.1467)


   

1,2,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

1,2,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodec-9-en-4-ol

C15H24O2 (236.1776)


   

11'-(acetyloxy)-3',10'-dihydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

11'-(acetyloxy)-3',10'-dihydroxy-1',5'-dimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate

C19H24O9 (396.142)


   

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-2'-[(acetyloxy)methyl]-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

(1's,2r,2'r,4's,7'r,9'r,10'r,11's)-2'-[(acetyloxy)methyl]-10',11'-dihydroxy-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate

C22H32O8 (424.2097)


   

(1r,2r,4r,6s,9r)-4-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-6-yl acetate

(1r,2r,4r,6s,9r)-4-hydroxy-1,2,11-trimethyl-8-oxatricyclo[7.4.0.0²,⁶]tridec-10-en-6-yl acetate

C17H26O4 (294.1831)


   

3-[(1r,4s,7s,10s,13s,16s,23r)-16-amino-3,6,9,12,15,28-hexahydroxy-10-(hydroxymethyl)-13-(2-methylpropyl)-4-octyl-20,22-dioxo-21-oxa-25,26-dithia-2,5,8,11,14,29-hexaazabicyclo[21.4.2]nonacosa-2,5,8,11,14,28-hexaen-7-yl]-2-hydroxypropanimidic acid

3-[(1r,4s,7s,10s,13s,16s,23r)-16-amino-3,6,9,12,15,28-hexahydroxy-10-(hydroxymethyl)-13-(2-methylpropyl)-4-octyl-20,22-dioxo-21-oxa-25,26-dithia-2,5,8,11,14,29-hexaazabicyclo[21.4.2]nonacosa-2,5,8,11,14,28-hexaen-7-yl]-2-hydroxypropanimidic acid

C36H60N8O12S2 (860.3772)


   

3-[(2s,5r,6r)-6-[(2z,4r,6s)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-4-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-2-one

3-[(2s,5r,6r)-6-[(2z,4r,6s)-4,6-dimethyloct-2-en-2-yl]-5-methyloxan-2-yl]-4-hydroxy-5-(4-hydroxyphenyl)-1-methylpyridin-2-one

C28H39NO4 (453.2879)


   

γ-decalactone

γ-decalactone

C10H18O2 (170.1307)


   

(1r,5ar,7s,9as,10s,11s,11ar)-7,10-dihydroxy-6,6,9a,11a-tetramethyl-1-[(2r)-6-methyl-5-methylideneheptan-2-yl]-1h,2h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-11-yl acetate

(1r,5ar,7s,9as,10s,11s,11ar)-7,10-dihydroxy-6,6,9a,11a-tetramethyl-1-[(2r)-6-methyl-5-methylideneheptan-2-yl]-1h,2h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-11-yl acetate

C32H50O4 (498.3709)


   

7-(2-hydroxy-1,4-dimethylcyclohex-3-en-1-yl)-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol

7-(2-hydroxy-1,4-dimethylcyclohex-3-en-1-yl)-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol

C15H24O4 (268.1675)