Exact Mass: 268.1472936
Exact Mass Matches: 268.1472936
Found 500 metabolites which its exact mass value is equals to given mass value 268.1472936,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Diethylstilbestrol
Diethylstilbestrol is a synthetic estrogen that was developed to supplement a womans natural estrogen production. In 1971, the Food and Drug Administration (FDA) issued a Drug Bulletin advising physicians to stop prescribing DES to pregnant women because it was linked to a rare vaginal cancer in female offspring. Diethylstilbesterol is found in gram bean. Diethylstilbestrol is a synthetic nonsteroidal estrogen used in the treatment of menopausal and postmenopausal disorders. It was also used formerly as a growth promoter in animals. According to the Fourth Annual Report on Carcinogens (NTP 85-002, 1985), diethylstilbestrol has been listed as a known carcinogen. (Merck, 11th ed). G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens
Michlers ketone
INTERNAL_ID 250; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9520; ORIGINAL_PRECURSOR_SCAN_NO 9519 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9492; ORIGINAL_PRECURSOR_SCAN_NO 9487 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9500; ORIGINAL_PRECURSOR_SCAN_NO 9498 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9534; ORIGINAL_PRECURSOR_SCAN_NO 9532 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9547; ORIGINAL_PRECURSOR_SCAN_NO 9546 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9470; ORIGINAL_PRECURSOR_SCAN_NO 9468 CONFIDENCE standard compound; INTERNAL_ID 250; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9520; ORIGINAL_PRECURSOR_SCAN_NO 9519 CONFIDENCE standard compound; INTERNAL_ID 2291 CONFIDENCE standard compound; INTERNAL_ID 8123 CONFIDENCE standard compound; INTERNAL_ID 4144
Equilin
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Same as: D04041
Histidylleucine
C12H20N4O3 (268.15353300000004)
Histidylleucine is a dipeptide composed of histidine and leucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
4-METHYL-2,4-BIS(4-HYDROXYPHENYL)PENT-1-ENE
RIPAZEPAM
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
Kamahine C
Kamahine A is a constituent of honey from Weinmannia racemosa. Found in honey from Kamali (Weinmannia racemosa)
3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid
3-Carboxy-4-methyl-5-pentyl-2-furanpropanoic acid is a urofuranic acid. Urofuranic acids are usually derived from furanoic acids, and have two carboxyl groups at the 3- and 4-positions of the furan ring.
Isoleucyl-Histidine
C12H20N4O3 (268.15353300000004)
Isoleucyl-Histidine is a dipeptide composed of isoleucine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Histidylisoleucine
C12H20N4O3 (268.15353300000004)
Histidylisoleucine is a dipeptide composed of histidine and isoleucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Leucyl-Histidine
C12H20N4O3 (268.15353300000004)
Leucyl-Histidine is a dipeptide composed of leucine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Hesperaline
Hesperaline is found in brassicas. Hesperaline is an alkaloid from seeds of damask violet (Hesperis matronalis Cruciferae
Estra-1,3,5,7,9-pentaene-3,17beta-diol
4-Bis(2-hydroxyethyl)amino-L-phenylalanine
C13H20N2O4 (268.14230000000003)
Histidinyl-Leucine
C12H20N4O3 (268.15353300000004)
[(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoyl] (2S,3S)-2-amino-3-methylpentanoate
C12H20N4O3 (268.15353300000004)
Estrogen
A steroid hormone that stimulates or controls the development and maintenance of female sex characteristics in mammals by binding to oestrogen receptors. The oestrogens are named for their importance in the oestrous cycle. (ChEBI). Estrogen is found in date and apricot. G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens
Papyracon B
Papyracon C
Ramacemide
D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D002491 - Central Nervous System Agents > D000927 - Anticonvulsants C78272 - Agent Affecting Nervous System D020011 - Protective Agents
2-Methyl-6-methoxy-4-phenyl-2,3-dihydro-3,3-dimethylbenzofuran
8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one
Salviolone
Salviolone is a natural product found in Salvia miltiorrhiza and Salvia paramiltiorrhiza with data available.
butyl 5-[(1R)-1-hydroxyethyl]-gamma-oxofuran-2-butanoate
(+-)-(2Xi,3aXi)-2-Methoxy-(3ar,7at)-hexahydro-spiro[cyclopropan-1,2-indan]-2r,3c-dicarbonsaeure|(+-)-(2Xi,3aXi)-2-methoxy-(3ar,7at)-hexahydro-spiro[cyclopropane-1,2-indan]-2r,3c-dicarboxylic acid
N-methyl-2-(methylamino)-N-(2-phenylethyl)benzamide
(1S,2Z,4S)-1-butyl-4-hydroxy-4-[(2S)-5-oxo-2,5-dihydrofuran-2-yl]but-2-en-1-yl acetate|5S-[(4S-acetyloxy)-(1S-hydroxy)-2Z-octenyl]-2(5H)-furanone|pectinolide H
3-hydroxy-5-methoxy-2,4-dimethyl-4-(2-methylbutyryloxy)-2,5-cyclohexadien-1-one
1b-Ethyl-1a,1b,3,4,8c,9,10,10a-octahydro-2H-oxireno(4,5-b(pyrido(3,2-c(carbazole
4-acetyl-2-[(1E)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3(2H)-one|huaspenone B
5-(5-carboxymethyl-2-oxocyclopentyl)-3-pentenyl acetate
3-hydroxy-5-methoxy-2,6-dimethyl-6-(2-methylbutyryloxy)-2,4-cyclohexadien-1-one
3-hydroxy-13-methyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
Acetic acid 3-(3,4,5-trimethoxyphenyl)propyl ester
Heudelotine
Heudelotine is a natural product found in Jatropha curcas and Ricinodendron heudelotii with data available.
Diethylstilbestrol
G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens CONFIDENCE standard compound; INTERNAL_ID 4237 CONFIDENCE standard compound; INTERNAL_ID 4161
NPE_269.1647_12.5
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1105
1,3-diethyldiphenylurea
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 1062
3,6-diphenylcyclohexane-1,2-diol [IIN-based on: CCMSLIB00000845865]
3,6-diphenylcyclohexane-1,2-diol [IIN-based: Match]
His-ile
C12H20N4O3 (268.15353300000004)
His-leu
C12H20N4O3 (268.15353300000004)
A dipeptide formed from L-histidine and L-leucine residues.
Ile-his
C12H20N4O3 (268.15353300000004)
A dipeptide composed of L-isoleucine and L-histidine joined by a peptide linkage.
Leu-his
C12H20N4O3 (268.15353300000004)
A dipeptide formed from L-leucine and L-histidine residues.
Phosphonic acid,P-(3,3-diethoxypropyl)-, diethyl ester
TRANS-2,3-DIFLUORO-1-METHOXY-4-(4-PROPYL-CYCLOHEXYL)-BENZENE
1-ethoxy-4-(4-ethylcyclohexyl)-2,3-difluorobenzene
3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine
Phenol,4-(3,4-dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl)-
tert-Butyl 4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate
C11H19F3N2O2 (268.13985499999995)
4-(TERT-BUTYL)-2-METHYL-[1,1-BIPHENYL]-4-CARBOXYLIC ACID
1,3-bis(3-cyanopropyl)tetramethyldisiloxane
C12H24N2OSi2 (268.14270939999994)
Deanol acetamidobenzoate
C13H20N2O4 (268.14230000000003)
C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant
(1Z,3Z)-1,4-DIIODO-2,3-DIMETHYL-BUTA-1,3-DIENE
C11H19F3N2O2 (268.13985499999995)
N-ETHYL-N-METHYL-3-(PYRROLIDIN-3-YL)BENZAMIDE HYDROCHLORIDE
tert-butyl N-[(5,6-dimethoxypyridin-2-yl)methyl]carbamate
C13H20N2O4 (268.14230000000003)
2-METHYLIDENE-1,4-DIMORPHOLINOBUTANE-1,4-DIONE
C13H20N2O4 (268.14230000000003)
4-(1,1-Difluoroethyl)phenylboronic Acid Pinacol Ester
tert-butyl 1,3-dioxo-2,7-diazaspiro[4.5]decane-7-carboxylate
C13H20N2O4 (268.14230000000003)
1-[4-(3-METHYL-4-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE
diethyl 1-amino-3-isopropyl-1H-pyrrole-2,4-dicarboxylate
C13H20N2O4 (268.14230000000003)
(4-Pentyl-4-biphenylyl)boronic acid
C17H21BO2 (268.16345160000003)
2-Methylnaphthalene-1-boronic Acid Pinacol Ester
C17H21BO2 (268.16345160000003)
2,5,11,14-tetraoxa-8-azoniabicyclo[13.4.0]nonadeca-1(19),15,17-triene
2-(4-ETHOXY-PHENYL)-6-METHYL-2H-BENZOTRIAZOL-5-YLAMINE
ethyl prop-2-enoate,N-(hydroxymethyl)-2-methylprop-2-enamide,prop-2-enenitrile
C13H20N2O4 (268.14230000000003)
7-(4-METHOXYPHENYL)-5,6-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE
4-[(4-ethoxyphenyl)iminomethyl]-N,N-dimethylaniline
1-(2-BENZO[1,3]DIOXOL-5-YL-IMIDAZO[1,2-A]PYRIDIN-3-YLMETHYL)-PIPERIDINE-4-CARBOXYLICACID
N-Ethyl-N-methyl-3-(3-pyrrolidinyl)benzamide hydrochloride (1:1)
cis-3-(Boc-aMino)-5-(trifluorMethyl)piperidine
C11H19F3N2O2 (268.13985499999995)
tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate
C11H19F3N2O2 (268.13985499999995)
4,4,5,5-Tetramethyl-2-(naphthalen-1-ylmethyl)-1,3,2-dioxaborolane
C17H21BO2 (268.16345160000003)
4,4,5,5-Tetramethyl-2-(naphthalen-2-ylmethyl)-1,3,2-dioxaborolane
C17H21BO2 (268.16345160000003)
2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-4-carbonitrile
4-[(2S)-2-Methylbutyl]-[1,1-biphenyl]-4-carboxylic acid
1-METHYL-3,4-DIHYDROSPIRO[CHROMENE-2,4-PIPERIDIN]-4-AMINE HYDROCHLORIDE
4-Acetylamino-2-(bis(2-hydroxyethyl)amino)anisole
C13H20N2O4 (268.14230000000003)
1-tert-Butyl 4-methyl 4-cyanopiperidine-1,4-dicarboxylate
C13H20N2O4 (268.14230000000003)
7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(4-methyl-1-piperazinyl)carbonyl]-, (1R,4S)-rel-
C13H20N2O4 (268.14230000000003)
D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor
Ornithine phenylacetate
C13H20N2O4 (268.14230000000003)
C78275 - Agent Affecting Blood or Body Fluid
5-methyl-N-(4,5,6-trimethylpyrimidin-2-yl)-1,3-benzoxazol-2-amine
2-Amino-7-[2-(2-hydroxy-1-hydroxymethyl-ethylamino)-ethyl]-1,7-dihydro-purin-6-one
N-Methyl-N-[3-phenyl-3-(2-pyridinyl)propyl]acetamide
2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-methylpentanoic acid
C12H20N4O3 (268.15353300000004)
(2S)-2-[[(2S,3S)-2-azaniumyl-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoate
C12H20N4O3 (268.15353300000004)
[(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoyl] (2S,3S)-2-amino-3-methylpentanoate
C12H20N4O3 (268.15353300000004)
Dihydroxy Melphatalan-d8
C13H20N2O4 (268.14230000000003)
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds
N-butylharmine
A member of the class of beta-carbolines that is 9H-beta-carboline substituted by a butyl group at position 9, methoxy group at position 7 and a methyl group at position 1. It is semisynthetic derivative of harmine and has been shown to exhibit significant anti-HIV activity.
N-(1,8-dimethyl-3-pyrazolo[3,4-b]quinolinyl)propanamide
2-tert-butyl-N-(phenylmethyl)-4-pyridinecarboxamide
4,6-dimethyl-N-[(E)-1-phenylethylideneamino]pyrimidine-2-carboxamide
N-(oxolan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine
(2R,3R,4R)-3-[4-(cyclohexen-1-yl)phenyl]-4-(hydroxymethyl)azetidine-2-carbonitrile
(2S,3R,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile
(9R,13S,14R)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
(R)-2-Methylbutyric acid (S)-1,5-dimethyl-2-oxo-4-methoxy-6-hydroxy-3,5-cyclohexadienyl ester
His-Leu zwitterion
C12H20N4O3 (268.15353300000004)
A dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of His-Leu. Major species at pH 7.3.
2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid
3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP)
Belongs to the class of organic compounds known as furanoid fatty acids. These are fatty acids containing a 5-alkylfuran-2-alkanoic acid
3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid
Belongs to the class of organic compounds known as furanoid fatty acids. These are fatty acids containing a 5-alkylfuran-2-alkanoic acid.
8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione
(2s,3s)-2-[(1z,3s)-3-hydroxyhept-1-en-1-yl]-6-oxo-2,3-dihydropyran-3-yl acetate
(1s,2s,3r)-3-acetyl-2-(4-carboxy-4-methylbut-3-en-1-yl)-2-methylcyclobutane-1-carboxylic acid
10-hydroxy-4,4,8-trimethyl-1h,2h,3h-cyclohepta[a]naphthalen-9-one
{4-[(2r)-1,2-dihydroxypropan-2-yl]-3-hydroxyphenyl}methyl 2-methylpropanoate
2-{[(2s)-2-(pyridin-3-yl)piperidin-1-yl]methyl}phenol
(3r,4as,6r)-6,8-dihydroxy-3-(4-oxopentyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one
(2s)-4-acetyl-2-[(1e,5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one
4-[4-(4-hydroxyphenyl)-2,3-dimethylbut-1-en-1-yl]phenol
(2z,5e)-5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one
(11s)-5-hydroxy-6,12,12-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1,3(8),4,6,14-pentaen-9-one
(2s,7r)-11-methoxy-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),3,9,12,14-pentaene
methyl 2-hydroxy-3-[4-hydroxy-2,5-bis(prop-1-en-1-yl)oxolan-3-ylidene]propanoate
(3r,4r,5s,6s)-4-[(2r,3r)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octane-5,6-diol
4,4a-dihydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-5,6,7,8-tetrahydronaphthalen-1-one
4-hydroxy-7-(hydroxymethyl)-3,3,6a,7a-tetramethyl-hexahydronaphtho[2,3-b]oxiren-2-one
2-[(2r,4ar,8r,8ar)-8,8a-dihydroxy-4a,8-dimethyl-hexahydro-1h-naphthalen-2-yl]prop-2-enoic acid
(1s,2r,3r,5r,8s)-3-hydroxy-8-(hydroxymethyl)-5-(2-hydroxypropan-2-yl)-2-methyltricyclo[4.4.0.0²,⁸]decan-7-one
(3s,3as,5ar,6r,9s,9as,9bs)-6-hydroxy-9-(hydroxymethyl)-3,5a-dimethyl-decahydronaphtho[1,2-b]furan-2-one
2-isopropyl-5,8-dimethyl-11,12-dioxatricyclo[5.3.2.0¹,⁵]dodec-9-ene-8-peroxol
methyl (2r)-2-hydroxy-3-[(2r,3e,4s,5s)-4-hydroxy-2,5-bis[(1e)-prop-1-en-1-yl]oxolan-3-ylidene]propanoate
1,4-dimethyl (2z)-2-methyl-3-[(1e)-oct-1-en-1-yl]but-2-enedioate
(1r,2r,5r,7s,8r)-2-isopropyl-5,8-dimethyl-11,12-dioxatricyclo[5.3.2.0¹,⁵]dodec-9-ene-8-peroxol
4-[2-(4-hydroxy-2-methyl-5-oxooxolan-2-yl)ethyl]-3-propyl-5h-furan-2-one
(5r,6r,7r,9s,10s)-6,9-dihydroxy-7-(2-hydroxypropan-2-yl)-3,10-dimethylspiro[4.5]dec-3-en-2-one
(3r,3as,5ar,6r,9s,9as,9bs)-6,9-dihydroxy-3,5a,9-trimethyl-octahydro-3h-naphtho[1,2-b]furan-2-one
(3r,3as,6r,6as,9r,10r,10as)-9,10-dihydroxy-3,6,9-trimethyl-octahydro-3h-naphtho[4a,4-b]furan-2-one
1-(4-hydroxy-3-methoxyphenyl)-3,5-octane-diol
{"Ingredient_id": "HBIN001481","Ingredient_name": "1-(4-hydroxy-3-methoxyphenyl)-3,5-octane-diol","Alias": "1-(4-hydroxy-3-methoxyphenyl)octane-3,5-diol; AC1NSWME","Ingredient_formula": "C15H24O4","Ingredient_Smile": "CCCC(CC(CCC1=CC(=C(C=C1)O)OC)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15882","TCMID_id": "10447","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1α,4α-dihydroxyeudesman-5α,6β,7α,11βh-12,6-olide
{"Ingredient_id": "HBIN002294","Ingredient_name": "1\u03b1,4\u03b1-dihydroxyeudesman-5\u03b1,6\u03b2,7\u03b1,11\u03b2h-12,6-olide","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "CC1C2CCC3(C(CCC(C3C2OC1=O)(C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5890","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-oxo-2β-[3-butanone]-3α-methyl-6β-[2-propanol formyl ester]-cyclohexane
{"Ingredient_id": "HBIN002942","Ingredient_name": "1-oxo-2\u03b2-[3-butanone]-3\u03b1-methyl-6\u03b2-[2-propanol formyl ester]-cyclohexane","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "CC1CCC(C(=O)C1CCC(=O)C)C(C)COC=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16287","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3α-hydroxyilicicacid
{"Ingredient_id": "HBIN007953","Ingredient_name": "3\u03b1-hydroxyilicicacid","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10223","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-oxo-11,12,13-trihydroxy-eudesm-4-ene
{"Ingredient_id": "HBIN009393","Ingredient_name": "3-oxo-11,12,13-trihydroxy-eudesm-4-ene","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "CC1=C2CC(CCC2(CCC1=O)C)C(CO)(CO)O","Ingredient_weight": "268.35 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16421","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5320341","DrugBank_id": "NA"}
4α,5α-epoxy-6α-hydroxy amorphan-12-oicacid
{"Ingredient_id": "HBIN010187","Ingredient_name": "4\u03b1,5\u03b1-epoxy-6\u03b1-hydroxy amorphan-12-oicacid","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "CC1CCC(C2(C1CCC3(C2O3)C)O)C(C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7107","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5β-hydroxyilicicacid
{"Ingredient_id": "HBIN011476","Ingredient_name": "5\u03b2-hydroxyilicicacid","Alias": "NA","Ingredient_formula": "C15H24O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10224","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,8-dihydroxy-isobutyryl-thymol
{"Ingredient_id": "HBIN012986","Ingredient_name": "7,8-dihydroxy-isobutyryl-thymol","Alias": "NA","Ingredient_formula": "C14H20O5","Ingredient_Smile": "CC(C)C(=O)OCC(C)(C1=C(C=C(C=C1)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5920","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-[(1s,4r,4as,6s,8as)-6,8a-dihydroxy-4,7-dimethyl-2,3,4,4a,5,6-hexahydro-1h-naphthalen-1-yl]propanoic acid
(4s,6s)-6-[(2r,5r)-5-hydroperoxy-6-methylhept-6-en-2-yl]-4-hydroxy-3-methylcyclohex-2-en-1-one
(5s,6r,7r,10r)-7-(1,2-dihydroxypropan-2-yl)-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-one
(6s)-6-[(2r,5r,6s)-4,5-dihydroxy-5-methyl-7-oxabicyclo[4.1.0]heptan-2-yl]-2-methylhept-2-en-4-one
5-(hydroxymethyl)-5-(3-isopropyl-6-oxohept-1-en-1-yl)oxolan-2-one
[1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate
4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate
(3s,3as,5r,6r,8ar)-5-hydroxy-7-[(3s)-3-hydroxybutyl]-3,6-dimethyl-3h,3ah,4h,5h,6h,8ah-cyclohepta[b]furan-2-one
(1ar,2ar,4s,6ar,7s,7ar)-4-hydroxy-7-(hydroxymethyl)-3,3,6a,7a-tetramethyl-hexahydronaphtho[2,3-b]oxiren-2-one
(1r,3s,6r,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one
(2s)-2-{[(2s,3s)-2-amino-1-hydroxy-3-methylpentylidene]amino}-3-(3h-imidazol-4-yl)propanoic acid
C12H20N4O3 (268.15353300000004)
(3r,3as,5ar,6r,9s,9as,9bs)-6-hydroxy-9-(hydroxymethyl)-3,5a-dimethyl-decahydronaphtho[1,2-b]furan-2-one
2-[(2r,4ar,5r,8r,8ar)-5,8-dihydroxy-4a,8-dimethyl-octahydronaphthalen-2-yl]prop-2-enoic acid
(1s,2r,5r,8r)-5-methyl-2-pentyl-3,11-dioxabicyclo[6.2.1]undecane-4,6-dione
2-[(1r,2s,6s,8r)-2,6-dimethyl-9,10-dioxatricyclo[6.2.2.0¹,⁶]dodec-11-en-12-yl]propane-2-peroxol
1-(3-hydroxyprop-1-en-2-yl)-4,7-dimethyl-3,4,4a,5,8,8a-hexahydro-2h-naphthalene-1,2,8-triol
5-hydroxy-4a-(hydroxymethyl)-3,8-dimethyl-decahydroazuleno[6,5-b]furan-2-one
(3s,5r,7s,7ar)-7,7a-dihydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,5,6,7-tetrahydroindene-4-carbaldehyde
1-(2,5-dihydroxy-2,6-dimethyl-4a,5,6,7,8,8a-hexahydro-1h-naphthalen-1-yl)-3-hydroxypropan-1-one
6-(6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl)-3-methylcyclohex-2-en-1-one
(2r,4e)-2-[(2s,5r)-5-ethenyl-5-methyloxolan-2-yl]-6-hydroperoxy-6-methylhept-4-en-3-one
(3s,5r,6r,6's)-5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one
methyl (2r,5r,6r)-5-hydroxy-2-[(1s,2e)-1-hydroxybut-2-en-1-yl]-6-[(1e)-prop-1-en-1-yl]-5,6-dihydro-2h-pyran-3-carboxylate
9,10-dihydroxy-3,6,9-trimethyl-octahydro-3h-naphtho[4a,4-b]furan-2-one
5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one
(4s,5ar,7r,9s,9ar,9bs)-3-(hydroxymethyl)-9,9a-dimethyl-2h,4h,5h,5ah,6h,7h,8h,9h,9bh-naphtho[1,2-b]furan-4,7-diol
(1as,3r,4r,4ar,8ar)-3-hydroxy-3,4a,8,8-tetramethyl-hexahydronaphtho[1,8a-b]oxirene-4-carboxylic acid
12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione
5-(2,6-dihydroxy-6-methylhept-4-en-2-yl)-4-hydroxy-2-methylcyclohex-2-en-1-one
(1ar,2s,3r,3as,7s,7ar,7bs)-1a-(3-hydroxyprop-1-en-2-yl)-7,7a-dimethyl-octahydronaphtho[1,2-b]oxirene-2,3-diol
(1ar,2as,4s,6ar,7s,7ar)-4-hydroxy-7-(hydroxymethyl)-3,3,6a,7a-tetramethyl-hexahydronaphtho[2,3-b]oxiren-2-one
1,4a-dimethyl-7-(1,2,3-trihydroxypropan-2-yl)-3,4,5,6,7,8-hexahydronaphthalen-2-one
4-acetyl-2-(5-hydroxyhex-1-en-1-yl)-5-methoxy-2-methylfuran-3-one
6,8,8-trimethyl-1h,3h,3ah,4h,5h,6h,6ah,7h,9h-azuleno[4,5-c]furan-3,4,7-triol
(2s)-2-[(1s,4s,4as,6r,8as)-4,6-dihydroxy-4,7-dimethyl-2,3,4a,5,6,8a-hexahydro-1h-naphthalen-1-yl]propanoic acid
8-(hydroxymethyl)-4,11,11-trimethylbicyclo[7.2.0]undeca-5,7-diene-1,2,4-triol
[(1r,4ar,7r,7as)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate
(1s,4as,6s,8ar)-1,4a-dihydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-5,6,7,8-tetrahydro-1h-naphthalen-2-one
(1s,2s,4s,4ar,7as,7br)-3-(hydroxymethyl)-6,6,7b-trimethyl-1h,2h,4h,4ah,5h,7h,7ah-cyclobuta[e]indene-1,2,4-triol
2-(5,8-dihydroxy-4a,8-dimethyl-octahydronaphthalen-2-yl)prop-2-enoic acid
(1r,1as,4s,4ar,7s,7as,7br)-4-hydroxy-1,7-bis(hydroxymethyl)-1,4-dimethyl-octahydrocyclopropa[e]azulen-3-one
4-(3-hydroxybutyl)-5-(hydroxymethyl)-10-methylidene-8-oxatricyclo[5.3.0.0³,⁵]decan-9-ol
(2s,4s,4ar,6r,7as,7br)-3,6-bis(hydroxymethyl)-6,7b-dimethyl-1h,2h,4h,4ah,5h,7h,7ah-cyclobuta[e]indene-2,4-diol
2-{7a-hydroxy-1a,4-dimethyl-octahydronaphtho[1,2-b]oxiren-7-yl}propanoic acid
4-acetyl-2-[(1e)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one
11-methoxy-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),3,9,12,14-pentaene
7-hydroperoxy-10-hydroxy-2,10-dimethyl-6-methylidenedodeca-2,11-dien-4-one
(3s,5r,6e)-9-(furan-3-yl)-2,6-dimethylnon-6-ene-2,3,5-triol
2-hydroxy-5-(hydroxymethyl)-1,4a-dimethyl-6-methylidene-hexahydro-2h-naphthalene-1-carboxylic acid
1a-(3-hydroxyprop-1-en-2-yl)-7,7a-dimethyl-octahydronaphtho[1,2-b]oxirene-2,3-diol
(6s)-6-[(2s,4e)-6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl]-3-methylcyclohex-2-en-1-one
(1s,3r,6s,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one
(4e)-2-(5-ethenyl-5-methyloxolan-2-yl)-6-hydroperoxy-6-methylhept-4-en-3-one
6,9-dihydroxy-3,5a,9-trimethyl-octahydro-3h-naphtho[1,2-b]furan-2-one
(2r)-2-[(1ar,3as,4r,7s,7ar,7bs)-7a-hydroxy-1a,4-dimethyl-octahydronaphtho[1,2-b]oxiren-7-yl]propanoic acid
4-methoxy-5-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol
1-(3-hydroxy-8,8-dimethyl-6,7-dihydro-5h-phenanthren-2-yl)ethanone
3,6-bis(hydroxymethyl)-6,7b-dimethyl-1h,2h,4h,4ah,5h,7h,7ah-cyclobuta[e]indene-2,4-diol
(3s,3as,5ar,6r,9r,9as,9bs)-6,9-dihydroxy-3,5a,9-trimethyl-octahydro-3h-naphtho[1,2-b]furan-2-one
5,5,9-trimethyl-2-methylidene-12-oxatricyclo[7.3.0.0³,⁶]dodecane-1,7,8-triol
(1r,5r,5as,9as,9bs)-6,6,9a-trimethyl-1h,3h,5h,5ah,7h,8h,9h-naphtho[1,2-c]furan-1,5,9b-triol
(3e,5e)-trideca-3,5-dien-7,9,11-triyn-1-yl 3-methylbutanoate
(3s,6s,6's,7r)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one
6-(5-hydroperoxy-2-hydroxy-6-methylhept-6-en-2-yl)-3-methylcyclohex-2-en-1-one
(1s,2r,3r,6s,7r,8s)-10-isopropyl-3,7-dimethyl-11,12-dioxatricyclo[5.3.2.0²,⁶]dodec-9-ene-8-peroxol
(2as,2br,5r,6r,6as,7s,7as)-5,6a,7-trihydroxy-1,1,2b,6-tetramethyl-hexahydro-2h-cyclobuta[a]inden-3-one
(8as)-8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one
3,4-dihydroxy-5-(2-hydroxy-6-methylhept-5-en-2-yl)-2-methylidenecyclohexan-1-one
5a,8,8-trimethyl-1h,3h,3ah,4h,5h,6h,7h,9h-naphtho[1,2-c]furan-3,5,6-triol
(3s,3ar,4ar,5r,7ar,8r,9ar)-5,8-dihydroxy-3,5,8-trimethyl-octahydro-3h-azuleno[6,5-b]furan-2-one
(6s)-6-[(1s,2r,4s,5r,6s)-4,5-dihydroxy-5-methyl-7-oxabicyclo[4.1.0]heptan-2-yl]-2-methylhept-2-en-4-one
3,6-bis(hydroxymethyl)-6,7b-dimethyl-1h,2h,2ah,4ah,5h,7h,7ah-cyclobuta[e]indene-1,2-diol
1-[(1r,2r,4ar,6s,8as)-2-hydroxy-6-(hydroxymethyl)-2-methyl-4a,5,6,7,8,8a-hexahydro-1h-naphthalen-1-yl]-3-hydroxypropan-1-one
(4s,6s)-6-[(1s,2e,4e)-1,6-dihydroxyhexa-2,4-dien-1-yl]-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one
(1s,2r,3r,5r,6s,8s)-3-hydroxy-8-(hydroxymethyl)-5-(2-hydroxypropan-2-yl)-2-methyltricyclo[4.4.0.0²,⁸]decan-7-one
5-(1,4-dihydroxy-2,2,6-trimethylcyclohexyl)-3-methylpenta-2,4-dienoic acid
(2s,3ar,4s,6r,8s,8ar)-2,8-dihydroxy-3a,6-dimethyl-4-(2-methylprop-1-en-1-yl)-hexahydro-2h-cyclohepta[b]furan-5-one
6,8-dihydroxy-3,5a,9-trimethyl-decahydronaphtho[1,2-b]furan-2-one
1-[(1r,2s,4ar,5r,6s,8as)-2,5-dihydroxy-2,6-dimethyl-4a,5,6,7,8,8a-hexahydro-1h-naphthalen-1-yl]-3-hydroxypropan-1-one
4-{2-[(2r,4r)-4-hydroxy-2-methyl-5-oxooxolan-2-yl]ethyl}-3-propyl-5h-furan-2-one
5-(6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl)-2-methylcyclohex-2-en-1-one
methyl (4s)-4-{[(1z,2s)-2-hydroxy-2-methyl-5-oxocyclopentylidene]methyl}-5-methylhexanoate
butyl 4-{5-[(1r)-1-hydroxyethyl]furan-2-yl}-4-oxobutanoate
4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate
methyl 2-[(2r,4as,7r,8s,8ar)-7,8-dihydroxy-4a-methyl-octahydro-1h-naphthalen-2-yl]prop-2-enoate
2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.0⁴,¹²]dodec-8(12)-ene-3,7,11-triol
1-[1,3-dihydroxy-8-(hydroxymethyl)-4,4-dimethylspiro[4.5]dec-7-en-1-yl]ethanone
4a,8-dihydroxy-3,5,8a-trimethyl-octahydro-3h-naphtho[2,3-b]furan-2-one
(1r,3s,3as,4s,8as)-3,4-dihydroxy-4-(hydroxymethyl)-7-isopropyl-1-methyl-1,2,3,3a,5,8a-hexahydroazulen-6-one
(5e,8r,9s,10s)-8,10-dihydroxy-6-(hydroxymethyl)-9-isopropyl-2-methylidenecyclodec-5-en-1-one
(2z,4s,7r,8r)-4,7,8-trihydroxy-3,7-dimethyl-10-(propan-2-ylidene)cyclodec-2-en-1-one
6,9-dihydroxy-7-(2-hydroxypropan-2-yl)-3,10-dimethylspiro[4.5]dec-3-en-2-one
(1r)-4-oxo-1-[(1s)-1,3,3-trimethyl-2-oxocyclohexyl]pentyl formate
6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one
(3z,6r,9z,12s)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione
(1s,2s,4s,5z,7z,9r)-8-(hydroxymethyl)-4,11,11-trimethylbicyclo[7.2.0]undeca-5,7-diene-1,2,4-triol
(4r,5s)-5-[(2r,5r)-2,5-dihydroxy-6-methylhept-6-en-2-yl]-4-hydroxy-2-methylcyclohex-2-en-1-one
(3r,3as,7r,7as)-3,7-dihydroxy-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-1,3,3a,7a-tetrahydroinden-4-one
4,6-dihydroxy-1-(hydroxymethyl)-1,4,7-trimethyl-octahydrocyclopropa[e]azulen-3-one
(2r)-2-[(1r,2r,3s,4r)-2-formyl-4-methyl-3-(3-oxobutyl)cyclohexyl]propanoic acid
(4as,7r)-1,4a-dimethyl-7-(1,2,3-trihydroxypropan-2-yl)-3,4,5,6,7,8-hexahydronaphthalen-2-one
(1s,2s,5s,6s,7r,8r,9s)-6,7-dihydroxy-1,4,4,8-tetramethyl-11-oxatricyclo[7.3.0.0²,⁵]dodecan-12-one
4-hydroxy-5-(hydroxymethyl)-8-isopropyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carboxylic acid
(3e,6e,10s)-2-hydroperoxy-10-hydroxy-2,6,10-trimethyldodeca-3,6,11-trien-5-one
2-(6,8-dihydroxy-4a,8-dimethyl-octahydronaphthalen-2-yl)prop-2-enoic acid
(1s,3ar,8as)-1-[(2s)-1,2-dihydroxypropan-2-yl]-3a-methyl-2,3,4,7,8,8a-hexahydro-1h-azulene-6-carboxylic acid
(3s,3as,5ar,6s,9r,9as,9bs)-6,9-dihydroxy-3,5a,9-trimethyl-octahydro-3h-naphtho[1,2-b]furan-2-one
(2z,4r,7s,8r)-4,7,8-trihydroxy-3,7-dimethyl-10-(propan-2-ylidene)cyclodec-2-en-1-one
(4s,4as,8as)-4-hydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydronaphthalen-1-one
(4s,4ar,5s,7r,8ar,9as)-3-(hydroxymethyl)-4a,5-dimethyl-2h,4h,5h,6h,7h,8h,8ah,9h,9ah-naphtho[2,3-b]furan-4,7-diol
(2ar,3r,4as,7ar,7br)-2a,4a-dihydroxy-3-(hydroxymethyl)-6,6,7b-trimethyl-hexahydrocyclobuta[e]inden-4-one
(2z,4e)-5-[(1s,3s,4r,6r)-3,4-dihydroxy-2,2,6-trimethylcyclohexyl]-3-methylpenta-2,4-dienoic acid
(1s,2r,3r,6r,8r,9r,10s)-1,11,11-trimethyl-4,7-dioxatetracyclo[8.4.0.0²,⁶.0⁶,⁸]tetradecane-3,9-diol
4a-hydroperoxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-5,6,7,8-tetrahydro-1h-naphthalen-2-one
5-hydroxy-7-(3-hydroxybutyl)-3,6-dimethyl-3h,3ah,4h,5h,6h,8ah-cyclohepta[b]furan-2-one
2-(1-hydroxy-5-methylhexyl)-6-methoxy-3,5-dimethylpyran-4-one
(2s,3s)-2,3-dimethyl-4-(3,4,5-trimethoxyphenyl)butan-1-ol
(2s,3r,4r,5r,6r)-2-methyl-6-(2-phenylethoxy)oxane-3,4,5-triol
(3r)-2-{3-methoxy-2,6-dimethyl-7ah-furo[2,3-b]pyran-4-yl}butane-2,3-diol
7-(2-hydroxy-1,4-dimethylcyclohex-3-en-1-yl)-7-methyl-1-oxaspiro[2.4]heptane-4,5-diol
(4r,4as,6r,8ar)-4,4a-dihydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-5,6,7,8-tetrahydronaphthalen-1-one
(3z,11z)-2,13-dihydroxy-7-methyl-6,15-dioxabicyclo[12.1.0]pentadeca-3,11-dien-5-one
(1s,2s,4r,5z,7e,9r)-8-(hydroxymethyl)-4,11,11-trimethylbicyclo[7.2.0]undeca-5,7-diene-1,2,4-triol
(3r,3ar,4r,6s,6as,7s)-6,8,8-trimethyl-1h,3h,3ah,4h,5h,6h,6ah,7h,9h-azuleno[4,5-c]furan-3,4,7-triol
(4r,6s,7r)-1-(furan-3-yl)-6,7-dihydroxy-4,8-dimethylnonan-1-one
6,7-dihydroxy-1,4,4,8-tetramethyl-11-oxatricyclo[7.3.0.0²,⁵]dodecan-12-one
(2z,4e)-5-[(1s,3s,4r,6s)-3,4-dihydroxy-2,2,6-trimethylcyclohexyl]-3-methylpenta-2,4-dienoic acid
2-(5-ethenyl-5-methyloxolan-2-yl)-6-hydroperoxy-6-methylhept-4-en-3-one
(1s,3s,4r,7s,8s,9s,10r)-7,9-dihydroxy-10-isopropyl-3,7-dimethyl-11-oxatricyclo[6.2.1.0⁴,⁹]undecan-6-one
(1r,3ar,5as,9as,9br)-1,3a-dihydroxy-6,6,9a-trimethyl-octahydronaphtho[1,2-c]furan-3-one
(1r,3r,4s,7s,9r,11s)-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.0⁴,¹²]dodec-8(12)-ene-3,7,11-triol
[4-(1,2-dihydroxypropan-2-yl)-3-hydroxyphenyl]methyl 2-methylpropanoate
3a,7-dihydroxy-6,6,9a-trimethyl-octahydronaphtho[1,2-c]furan-1-one
(3r,3ar,5s,5ar,6s)-5a,8,8-trimethyl-1h,3h,3ah,4h,5h,6h,7h,9h-naphtho[1,2-c]furan-3,5,6-triol
1,3a-dihydroxy-6,6,9a-trimethyl-octahydronaphtho[1,2-c]furan-3-one
(3r,3as,5s,5ar,6r,9r,9as,9bs)-6,9-dihydroxy-3,5,9-trimethyl-decahydronaphtho[1,2-b]furan-2-one
1,9,9a-trimethyl-2h,3ah,4h,5h,7h,8h,9h,9bh-naphtho[2,1-b]furan-1,2,7-triol
(5r,6r,7r,8s)-8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one
(2s,4r,4as,8r,8as)-1-(3-hydroxyprop-1-en-2-yl)-4,7-dimethyl-3,4,4a,5,8,8a-hexahydro-2h-naphthalene-1,2,8-triol
(1s,2s,4s,7e,9r)-8-(hydroxymethyl)-4,11,11-trimethylbicyclo[7.2.0]undeca-5,7-diene-1,2,4-triol
(8ar)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione
4-[2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octane-5,6-diol
8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one
7-(1,2-dihydroxypropan-2-yl)-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-one
5-(hydroxymethyl)-1,14-dimethyl-3,7-dioxatetracyclo[8.4.0.0²,⁴.0⁴,⁸]tetradecan-5-ol
(1s,2r,4s,4ar,7as,7br)-3-(hydroxymethyl)-6,6,7b-trimethyl-1h,2h,4h,4ah,5h,7h,7ah-cyclobuta[e]indene-1,2,4-triol
(1s,2r,3s,4s,5r,6r,7s,8r,10r)-3-(hydroxymethyl)-10-[(2s)-1-hydroxypropan-2-yl]-7-methyltetracyclo[4.4.0.0²,⁴.0³,⁷]decane-5,8-diol
(1r,4s,7r,8s,11r)-3,3,7,11-tetramethyl-12-oxatricyclo[6.3.1.0¹,⁵]dodec-5-ene-4,7,8-triol
8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
4-[(2e,6s)-6-carboxy-6-methylhex-2-en-2-yl]cyclohexane-1-carboxylic acid
5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one
7-hexyl-4-methoxy-4ah,7h,7ah-furo[3,4-b]pyran-2,5-dione
6,6,9a-trimethyl-1h,3h,5h,5ah,7h,8h,9h-naphtho[1,2-c]furan-1,5,9b-triol
2-[(1s)-1-hydroxyheptyl]-6-methoxy-3,5-dimethylpyran-4-one
(2r,3s,5r,7s,7ar)-2,7-dihydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-5,6,7,7a-tetrahydro-2h-indene-4-carbaldehyde
(2e,6e)-3,7,11-trimethyldodeca-2,6-dienedioic acid
2-[4-methyl-2-oxo-3-(3-oxobutyl)cyclohexyl]propyl formate
(1s,2z,4s)-1-hydroxy-1-[(2s)-5-oxo-2h-furan-2-yl]oct-2-en-4-yl acetate
(2's,4's,6'r,7's)-4'-(hydroxymethyl)-1',4'-dimethyl-10'-oxaspiro[cyclopropane-1,11'-tricyclo[6.2.1.0²,⁶]undecane]-7',8'-diol
butyl 4-[5-(1-hydroxyethyl)furan-2-yl]-4-oxobutanoate
(3s,4s,5s)-1-(furan-3-yl)-4,8-dimethylnon-7-ene-3,4,5-triol
1-(4,5-dihydroxy-2,6-dimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)-3-hydroxypropan-1-one
6-hydroxy-3-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-10-methylspiro[4.5]dec-3-en-2-one
2-[4-methyl-2-oxo-3-(3-oxobutyl)cyclohexyl]propan-2-yl formate
(1s,3ar,4s,8as)-1,4-dihydroxy-4-(hydroxymethyl)-7-isopropyl-1-methyl-3,3a,5,8a-tetrahydro-2h-azulen-6-one
3-[(3s,5s)-3,5-dihydroxyhexanimidoyl]-5-(propan-2-ylidene)pyrrole-2,4-diol
C13H20N2O4 (268.14230000000003)
2-[(1s,2r,4ar,8r,8as)-1,8-dihydroxy-4a,8-dimethyl-octahydronaphthalen-2-yl]prop-2-enoic acid
3a,6-dihydroxy-7-(2-hydroxypropan-2-yl)-1,4-dimethyl-3,4,5,6,7,8-hexahydroazulen-2-one
2a,7a-dihydroxy-6-(hydroxymethyl)-3,6,7b-trimethyl-hexahydrocyclobuta[e]inden-4-one
(2s)-4-acetyl-2-[(5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one
3-(hydroxymethyl)-9,9a-dimethyl-2h,4h,5h,5ah,6h,7h,8h,9h,9bh-naphtho[1,2-b]furan-4,7-diol
5-(2,5-dihydroxy-6-methylhept-6-en-2-yl)-4-hydroxy-2-methylcyclohex-2-en-1-one
(5s,6r,7r,8s,10r)-6,8-dihydroxy-7-(2-hydroxypropan-2-yl)-3,10-dimethylspiro[4.5]dec-3-en-2-one
(1's,2's,4's,6'r,7's,8's)-4'-(hydroxymethyl)-1',4'-dimethyl-10'-oxaspiro[cyclopropane-1,11'-tricyclo[6.2.1.0²,⁶]undecane]-7',8'-diol
6-hydroxy-10-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-3-methylspiro[4.5]dec-3-en-2-one
(3s,3ar,4ar,5r,7ar,8s,9ar)-5,8-dihydroxy-3,5,8-trimethyl-octahydro-3h-azuleno[6,5-b]furan-2-one
2-[(2r,4as,6r,8s,8ar)-6,8-dihydroxy-4a,8-dimethyl-octahydronaphthalen-2-yl]prop-2-enoic acid
1,11,11-trimethyl-4,7-dioxatetracyclo[8.4.0.0²,⁶.0⁶,⁸]tetradecane-3,9-diol
6,7-dihydroxy-6-methyl-2-(2-methylpropanoyl)-4,5,7,7a-tetrahydro-3ah-1-benzofuran-3-carbaldehyde
3-(hydroxymethyl)-6,6,7b-trimethyl-1h,2h,4h,4ah,5h,7h,7ah-cyclobuta[e]indene-1,2,4-triol
(3as,4s,6r,7s)-3a,6-dihydroxy-7-(2-hydroxypropan-2-yl)-1,4-dimethyl-3,4,5,6,7,8-hexahydroazulen-2-one
(4as,6s,8as)-4,6-dihydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydronaphthalen-1-one
(4e)-2-[(2s,5r)-5-ethenyl-5-methyloxolan-2-yl]-6-hydroperoxy-6-methylhept-4-en-3-one
(2r)-2-[(1s,4r,4as,7r)-7-hydroperoxy-4,7-dimethyl-2,3,4,4a,5,6-hexahydro-1h-naphthalen-1-yl]propanoic acid
[(1s,4as,7s,7ar)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate
(1r)-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate
(3z,6r,9z,11r,13r)-11-(hydroxymethyl)-6,13-dimethyl-1,7-dioxacyclotrideca-3,9-diene-2,8-dione
(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl (2r)-2-methylbutanoate
1-hydroxy-1-(5-oxo-2h-furan-2-yl)oct-2-en-4-yl acetate
(6r,7s,8s)-8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
2-{[(2r)-2-(pyridin-3-yl)piperidin-1-yl]methyl}phenol
(2s)-2-{[(2s)-2-amino-1-hydroxy-3-(3h-imidazol-4-yl)propylidene]amino}-4-methylpentanoic acid
C12H20N4O3 (268.15353300000004)
5-methoxy-4-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol
6-(1,6-dihydroxyhexa-2,4-dien-1-yl)-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one
3-(3,5-dihydroxyhexanimidoyl)-5-(propan-2-ylidene)pyrrole-2,4-diol
C13H20N2O4 (268.14230000000003)
(3s,6s,6's,7s)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one
(8s)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one
(2r)-2,3-dihydroxy-2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate
(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate
(8as)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione
5,5'-dihydroxy-4,4',8,8-tetramethyl-7-oxaspiro[bicyclo[3.2.1]octane-6,2'-oxolan]-3-en-2-one
n-[(3s,9z)-8-hydroxy-10-methyl-2-oxo-1-oxa-7-azacyclododeca-7,9-dien-3-yl]ethanimidic acid
C13H20N2O4 (268.14230000000003)