Exact Mass: 262.1469908
Exact Mass Matches: 262.1469908
Found 338 metabolites which its exact mass value is equals to given mass value 262.1469908
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
streptidine
C8H18N6O4 (262.13894680000004)
An amino cyclitol that is scyllo-inositol in which the hydroxy groups at positions 1 and 3 are replaced by guanidino groups.
Etoglucid
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AG - Epoxides C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents
Phaseolic acid
Phaseolic acid is found in pulses. Phaseolic acid is isolated from dry bean seeds (Phaseolus sp. Isolated from dry bean seeds (Phaseolus species). Phaseolic acid is found in pulses.
4-Amino-3-hydroxybutanoylcarnitine
4-Amino-3-hydroxybutanoylcarnitine is an acylcarnitine. More specifically, it is an 4-amino-3-hydroxybutanoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. 4-Amino-3-hydroxybutanoylcarnitine is therefore classified as a short chain AC. As a short-chain acylcarnitine 4-Amino-3-hydroxybutanoylcarnitine is a member of the most abundant group of carnitines in the body, comprising more than 50\\% of all acylcarnitines quantified in tissues and biofluids (PMID: 31920980). Some short-chain carnitines have been studied as supplements or treatments for a number of diseases, including neurological disorders and inborn errors of metabolism. Carnitine acetyltransferase (CrAT, EC:2.3.1.7) is responsible for the synthesis of all short-chain and short branched-chain acylcarnitines (PMID: 23485643). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].
Cibenzoline
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
Homosalate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates D020011 - Protective Agents > D011837 - Radiation-Protective Agents > D013473 - Sunscreening Agents C1892 - Chemopreventive Agent > C851 - Sunscreen D003879 - Dermatologic Agents D003358 - Cosmetics
Streptidine
C8H18N6O4 (262.13894680000004)
(E)-5-(2,6-Dimethyl-5,7-octadienyl)-3-furancarboxylic acid methyl ester
4,5,6,9,10,10a-Hexahydro-10a-methoxy-6,7,8-trimethyl-6,10-methano-2H-cyclonona[b]furan-2-one
[1R-(1alpha,4abeta,6alpha,8aalpha)]-1,2,4a,5,6,8a-Hexahydro-6-hydroxy-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester
(Z)-5-(2,6-Dimethyl-5,7-octadienyl)-3-furancarboxylic acid methyl ester
3-{[2-(carboxymethoxy)ethoxy]methyl}heptanoic acid
2,2,7-Trimethyl-3-hydroxy-4-isopropyl-6-methoxyindan-1-one
1-Isopropyl-6-methoxy-7-methyl-1,2,3,4-tetrahydro-1,4-(epoxymethano)naphthalene-5-ol
2-Hydroxy-5-(1,1,3,3-tetramethyl-butyl)-isophthalaldehyd|2-hydroxy-5-(1,1,3,3-tetramethyl-butyl)-isophthalaldehyde
(+)-(1R)-(2Z,4E)-4-Oxo-alpha-ionylideneacetic acid methyl ester|(+-)-Abscisin-methylester|(+/-)-1-deoxyabscisic acid methyl ester|4-Keto-2-cis-alpha-ionylidenessigsaeuremethylester|Abscissinsaeure-methylester|methyl 3-methyl-5-(4-oxo-2,6,6-trimethyl-2-cyclohexen-1-yl)-2(Z),4(E)-pentadienoate|methyl 3-methyl-5-(4-oxo-2,6,6-trimethylcyclohex-2-en-1(S)-yl)-2(Z),4(E)-pentadienoate
(1R,2S,4S,5S)-2-methoxy-5-[(1R)-1-phenyl-2-propenyl]-1,4-cyclohexanediol|(1S,2S,4S,5S)-2-methoxy-5-[(1R)-1-phenyl-2-propenyl]-1,4-cyclohexanediol
(+)-O-methylfurodysinin lactone|O-methylfurodysinin lactone
[(1(10)E,2R,4R)]-2-Methoxy-8,12-epoxygemacra-1(10),7,11-trien-6-one
3beta,4beta-Dimethyl-7beta-(1-carbomethoxy-aethyl)-9,10-dehydro-decal-8-on
Methyl 12-oxo-8??-hydroxyabiet-13-en-19-oate|Methyl 8-oxo-??-humula-6E,9E-dien-12-oate|Methyl 8-oxo-??-humula-6E,9Z-dien-12-oate
2-(1,5-Dimethyl-4-hexenyl)-3-methoxy-5-methyl-1,4-benzoquinone
(7E,9Z,12Z)-6-ketohexadeca-7,9,12,15-tetraenoic acid
5-Hydroxy-2-methyoxy-15-calamenen-15-al|5-hydroxy-8-methoxy-calamenene-6-al
1,2-bis(2,2-dimethyl-1,3-dioxolan-4-yl)ethane-1,2-diol
1-hydroxyherbertene-12-oic acid methyl ester|mastigophoric acid methyl ester|methyl 4-hydroxy-3-[(1S)-1,2,2-trimethylcyclopentyl]benzoate
4beta-Methoxydehydrocostus lactone|4??-Methoxycostuslactone
(2R,3R)-2-heptyl-3,4-dihydroxyindan-1-one|paecilocin D
4beta-hydroxy-5beta,8beta(H)-guaia-1(10)Z,7(11)Z-dien-12,8-olide|chlospicate C
10alpha-hydroxy-1alpha,5alpha,8beta(H)-guaia-4(15),7(11)Z-dien-12,8-olide|chlospicate D
(4aR,5S,9aR)-4a,5,6,7,9,9a-hexahydro-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one|8alpha-methoxyeremophila-1(10),7(11)-dien-12,8beta-olide
2-Oxo-3beta-(1-methoxycarbonylethyl)-5-methylen-8abeta-methyl-1.2.3.4.4aalpha.5.6.8a-octahydro-naphthalin
(+)-methyl 3-oxo-1alphaH,7alphaH,10alphaH-guaia-4,11-dien-12-oate|(+)-methyl pechueloate|methyl pechueloate|Pechueloic acid methylester
2-(1Z)-(3-hydroxy-3,7-dimethylocta-1,6-dienyl)-1,4-benzenediol|2-(2Z)-(3-hydroxy-3,7-dimethyloct-2,6-dienyl)-1,4-benzenediol
6-(1-Ethoxyethyl)-7-methoxy-2,2-dimethyl-2H-1-benzopyran
(E)-2-Hexenyl Beta-D-Glucopyranoside|(E)-2-hexenyl beta-D-glucoside|(E)-2-hexenyl-beta-D-glucopyranoside|(E)-2-Hexenyl-??-D-glucopyranoside|erigeside B
2,2,7,7-Tetramethyl-2,3,4,7,8,9-hexahydrobenzo[1,2-b:4,5-b]dipyran-5-ol
2alpha-hydroxy-5alphaH-eudesma-4(15),11(13)-dien-12,8beta-olide
1-allyl-3,5-dimethoxy-4-(3-methyl-but-2-enyloxy)benzene
5-methyl-5-<2-(2,6,6-trimethyl-3-oxo-1-cyclohexen-1-yl)vinyl>-2-tetrahydrofuranone|5-methyl-5-[2-(2,6,6-trimethyl-3-oxo-1-cyclohexen-1-yl)vinyl]-2-tetrahydrofuranone
(1(10)E,2R*,4R*)-2-Methoxy-8,12-epoxygermacra-1(10),7,11-trien-6-one
C12H22O6_beta-D-Glucopyranoside, (3Z)-3-hexen-1-yl
(2R,3R,4S,5S,6R)-2-[(Z)-hex-3-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
1COOH-2But-A7EO1-OCH2COOH
Literature spectrum; CONFIDENCE Tentative identification: isomers possible (Level 3); Could be alkyl homologue of given structure; Digitised from figure: approximate intensities
(2R,3R,4S,5S,6R)-2-[(Z)-hex-3-enoxy]-6-(hydroxymethyl)oxane-3,4,5-triol_major
Homosalate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates D020011 - Protective Agents > D011837 - Radiation-Protective Agents > D013473 - Sunscreening Agents C1892 - Chemopreventive Agent > C851 - Sunscreen D003879 - Dermatologic Agents D003358 - Cosmetics
ascr#12
An (omega-1)-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of (5R)-5-hydroxyhexanoic acid with ascarylopyranose (the alpha anomer). It is a metabolite of the nematodes Caenorhabditis elegans and Pristionchus pacificus.
oscr#12
An omega-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of 6-hydroxyhexanoic acid with ascarylopyranose (the alpha anomer). It is a metabolite of the nematode Caenorhabditis elegans.
3-(2,2-DIMETHYL-TETRAHYDRO-PYRAN-4-YL)-3-PHENYL-PROPIONIC ACID
Phenylacetic acid-4-boronic acid pinacol ester
C14H19BO4 (262.13763240000003)
2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
C14H19BO4 (262.13763240000003)
2-Amino-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carbonitrile
3-[4-(2-ETHOXYCARBONYL-ETHOXY)-BUTOXY]-PROPIONICACID
2-(N-Methylaminocarbonyl)-5-pyridineboronic acid pincol ester
Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
C14H19BO4 (262.13763240000003)
3-(Carboxymethyl)phenylboronic acid, pinacol ester
C14H19BO4 (262.13763240000003)
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzohydrazide
2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate
C14H19BO4 (262.13763240000003)
N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)ACETAMIDE
1,4-Benzodioxane-6-boronic acid, pinacol ester
C14H19BO4 (262.13763240000003)
{1H-Pyrido[4,3-b]indole,} 2,3,4,5-tetrahydro-2-(phenylmethyl)-
(R)-TERT-BUTYL (1-([1,2,4]TRIAZOLO[4,3-A]PYRIDIN-3-YL)ETHYL)CARBAMATE
3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
C14H19BO4 (262.13763240000003)
(S)-TERT-BUTYL (1-([1,2,4]TRIAZOLO[4,3-A]PYRIDIN-3-YL)ETHYL)CARBAMATE
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate
C14H19BO4 (262.13763240000003)
[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate
C14H19BO4 (262.13763240000003)
1H-Pyrrolo[2,3-b]pyridine-5-methanol, 1-[(1,1-dimethylethyl)dimethylsilyl]-
TERT-BUTYL 2,7-DIAZASPIRO[4.4]NONANE-2-CARBOXYLATE HYDROCHLORIDE
1-(DIPHENYLMETHYL)-3-METHYL-3-AZETIDINECARBONITRILE
2-(3,4-dimethoxyphenyl)ethyl-(furan-2-ylmethyl)azanium
2-(2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)ACETIC ACID
C14H19BO4 (262.13763240000003)
2-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
C14H19BO4 (262.13763240000003)
3-Methoxycarbonylphenylboronic acid pinacol ester
C14H19BO4 (262.13763240000003)
2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
C14H19BO4 (262.13763240000003)
TERT-BUTYL 8-AZABICYCLO[3.2.1]OCTAN-3-YLCARBAMATE HYDROCHLORIDE
5-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
C14H19BO4 (262.13763240000003)
METHYL 2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE
C14H19BO4 (262.13763240000003)
4-Methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
C14H19BO4 (262.13763240000003)
2-methoxy-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
C14H19BO4 (262.13763240000003)
3-Amino-8-aza-bicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester hydrochloride
N-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinamide
4-Methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)benzoic acid
C14H19BO4 (262.13763240000003)
N-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)acetamide
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)urea
3-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
C14H19BO4 (262.13763240000003)
tert-butyl octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride
Fencibutirol
C78276 - Agent Affecting Digestive System or Metabolism > C66913 - Cholagogues or Choleretic Agents
(5R)-5-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]hexanoic acid
6-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]hexanoic acid
Cibenzoline
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
2-(3,7-Dimethylocta-2,6-dienyl)benzene-1,3,5-triol
2-methoxy-3,5-dimethyl-6-[(2e,4e)-4-methylhepta-2,4-dien-2-yl]pyran-4-one
(4ar,8as,9as)-9a-methoxy-4,4,7-trimethyl-4ah,5h,6h,8ah,9h-naphtho[2,3-b]furan-2-one
methyl 2-[(1r,4ar,6s,8ar)-6-hydroxy-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalen-1-yl]prop-2-enoate
methyl 2-[(2r,5s,10s)-6,10-dimethyl-8-oxospiro[4.5]dec-6-en-2-yl]prop-2-enoate
methyl 4-hydroxy-3-(1,2,2-trimethylcyclopentyl)benzoate
2-methoxy-3,5-dimethyl-6-[(2e,4z)-4-methylhepta-2,4-dien-2-yl]pyran-4-one
(1r,3s,5r,7r,8e,11r)-5,7,9-trimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.0³,⁵]tetradec-8-en-13-one
(3s,3ar,4r,6ar,8s,9ar,9br)-3-methyl-2,6,9-trimethylidene-octahydro-3h-azuleno[4,5-b]furan-4,8-diol
methyl (5s,8s)-5-hydroxy-8-isopropyl-5-methyl-7,8-dihydro-6h-naphthalene-2-carboxylate
(1r,3r,7e)-3,7-dimethyl-14,16-dioxatricyclo[8.6.0.0¹¹,¹⁵]hexadeca-7,11(15)-dien-6-one
(2r,3r,4s,5s,6r)-2-(hex-3-en-1-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(5s,8r)-1-hydroxy-8-isopropyl-4-methoxy-5-methyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde
methyl 2-(8-formyl-4a-methyl-2,3,4,5,6,7-hexahydro-1h-naphthalen-2-yl)prop-2-enoate
(4s)-4,5-dimethoxy-4-(3-methylbut-2-en-1-yl)-2-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-one
(3as,6s,6as,9bs)-6-hydroxy-6,6a,9-trimethyl-3-methylidene-3ah,4h,5h,7h,8h,9bh-azuleno[4,5-b]furan-2-one
(1r,3s,4s,5r,7r)-3,5-dimethyl-10-methylidene-4-(3-oxobutyl)-8-oxatricyclo[5.3.0.0³,⁵]decan-9-one
(1s,2r,9r)-2-methoxy-9,10,11-trimethyl-3-oxatricyclo[7.3.1.0²,⁶]trideca-5,10-dien-4-one
(8as,10ar)-5,5-dimethyl-6,7,8,9,10,10a-hexahydroanthracene-1,4,8a-triol
7-methoxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),8,10-trien-3-ol
(3ar,6s,7as,8s,9ar)-6-methoxy-5,8-dimethyl-3-methylidene-3ah,4h,6h,7h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-2-one
(3r,4s,7s)-7-methoxy-2,2,4,9-tetramethyl-6-oxatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),8,10-trien-3-ol
methyl (1e,5z,8z)-4,4,8-trimethyl-7-oxocycloundeca-1,5,8-triene-1-carboxylate
(3ar,6r,7as,8s,9ar)-6-methoxy-5,8-dimethyl-3-methylidene-3ah,4h,6h,7h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-2-one
methyl 2-{6,10-dimethyl-8-oxospiro[4.5]dec-6-en-2-yl}prop-2-enoate
2-methoxy-3,5-dimethyl-6-[(2e)-4-methylhepta-2,4-dien-2-yl]pyran-4-one
(3s,3as,6ar,9ar,9bs)-3-(methoxymethyl)-6,9-dimethylidene-octahydro-3h-azuleno[4,5-b]furan-2-one
methyl 2-(4a,8-dimethyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-2-yl)prop-2-enoate
8-methoxy-3,6,10-trimethyl-5h,6h,7h,8h,11h-cyclodeca[b]furan-4-one
2-(3-methylbut-2-en-1-yl)-6-(3-methylbut-3-en-1-yn-1-yl)cyclohex-5-ene-1,2,4-triol
(6r,8r)-8-methoxy-3,6,10-trimethyl-5h,6h,7h,8h,11h-cyclodeca[b]furan-4-one
methyl 2-[(2z,8s,8ar)-8,8a-dimethyl-3-oxo-5,6,7,8-tetrahydro-1h-naphthalen-2-ylidene]propanoate
5-hydroxy-1-(3-methylbut-2-en-1-yl)-3-(3-methylbut-2-en-1-ylidene)-7-oxabicyclo[4.1.0]heptan-2-one
(1(10)E,2R,4R)-2-methoxy-8,12-epoxygermacra-1(10),7,11-trien-6-one(6),myrrhone
{"Ingredient_id": "HBIN000230","Ingredient_name": "(1(10)E,2R,4R)-2-methoxy-8,12-epoxygermacra-1(10),7,11-trien-6-one(6),myrrhone","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "CC1CC(C=C(CC2=C(C(=CO2)C)C(=O)C1)C)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42295","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1(10)E, 2R, 4R)-8,12- epoxy Zimmer-1,7,10,11- four-6-one
{"Ingredient_id": "HBIN000232","Ingredient_name": "1(10)E, 2R, 4R)-8,12- epoxy Zimmer-1,7,10,11- four-6-one","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "CC1CC(C=C(CC2=C(C(=CO2)C)C(=O)C1)C)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42315","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
12-methoxydihydrocostus lactone
{"Ingredient_id": "HBIN000898","Ingredient_name": "12-methoxydihydrocostus lactone","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "COCC1C2CCC(=C)C3CCC(=C)C3C2OC1=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31536","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4b-methoxydehydrocostus lactone
{"Ingredient_id": "HBIN010274","Ingredient_name": "4b-methoxydehydrocostus lactone","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "CC1(CCC2C1C3C(CCC2=C)C(=C)C(=O)O3)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31534","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acrifolinol
{"Ingredient_id": "HBIN014608","Ingredient_name": "acrifolinol","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "CC12CCC3C(CC(=O)C3=C)C4C(O4)(CCC1O2)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "568","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acutifolone a
{"Ingredient_id": "HBIN014660","Ingredient_name": "acutifolone a","Alias": "NA","Ingredient_formula": "C16H22O3","Ingredient_Smile": "CC1CCC2(C1(C(=O)C=C(C2C)C=C)C(=O)OC)C","Ingredient_weight": "262.34 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "600","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10539422","DrugBank_id": "NA"}
3-methoxy-5-methyl-2-[(2r)-6-methylhept-5-en-2-yl]cyclohexa-2,5-diene-1,4-dione
1-(hydroxymethyl)-7-isopropyl-3-methoxy-4a-methyl-5,6-dihydronaphthalen-2-one
(4r,4ar,5r)-4-methoxy-3,4a,5-trimethyl-4h,6h,7h,9h-naphtho[2,3-b]furan-5-ol
(2r,3r,4s,5s,6r)-2-[(3z)-hex-3-en-1-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(6s,8s)-8-methoxy-3,6,10-trimethyl-5h,6h,7h,8h,11h-cyclodeca[b]furan-4-one
methyl 4-hydroxy-3-[(1s)-1,2,2-trimethylcyclopentyl]benzoate
9a-methoxy-3,5,8-trimethyl-4h,6h,7h,7ah,8h,9h-azuleno[6,5-b]furan-2-one
4-methoxy-3,4a,5-trimethyl-4h,6h,7h,9h-naphtho[2,3-b]furan-5-ol
8a-methyl-2,3,5-trimethylidene-hexahydro-3ah-naphtho[2,3-b]furan-4a-peroxol
4a,8,10b-trimethyl-2h,3h,6ah,7h,8h,9h,10ah-naphtho[2,1-b]pyran-1,10-dione
2-methoxy-3,5-dimethyl-6-[(2z)-4-methylhepta-2,4-dien-2-yl]pyran-4-one
methyl (2z,4e)-3-methyl-5-[(1s)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]penta-2,4-dienoate
2-[(2e,6e)-8-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]benzene-1,4-diol
3-hydroxy-4-isopropyl-6-methoxy-2,2,7-trimethyl-3h-inden-1-one
methyl (2r)-2-[(1ar,1bs,4r,5ar,6as)-1b-methyl-6-methylidene-3-oxo-hexahydro-1h-cyclopropa[a]inden-4-yl]propanoate
2-(hex-2-en-1-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
methyl (1s,2s,5r,8r,9s)-2,5,9-trimethyl-11-oxotricyclo[6.3.0.0¹,⁵]undec-3-ene-3-carboxylate
2-(8-hydroxy-3,7-dimethylocta-2,6-dien-1-yl)benzene-1,4-diol
(1s,2s,4r,7z,10r,11s)-4,8,10-trimethyl-12-methylidene-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-7-en-13-one
(7e,9z,12z)-6-oxohexadeca-7,9,12,15-tetraenoic acid
2-(3-hydroxy-3-methylbut-1-en-1-yl)-6-(3-methylbut-2-en-1-yl)benzene-1,4-diol
methyl 5-hydroxy-8-isopropyl-5-methyl-7,8-dihydro-6h-naphthalene-2-carboxylate
(4ar,8as,9ar)-9a-methoxy-3,8a-dimethyl-5-methylidene-4h,4ah,6h,7h,8h,9h-naphtho[2,3-b]furan-2-one
(4ar,8ar,9ar)-9a-methoxy-3,8a-dimethyl-5-methylidene-4h,4ah,6h,7h,8h,9h-naphtho[2,3-b]furan-2-one
2-[(1z,3s)-3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl]benzene-1,4-diol
9a-methoxy-3,8a-dimethyl-5-methylidene-4h,4ah,6h,7h,8h,9h-naphtho[2,3-b]furan-2-one
n-[(1r,2s,3s,4r,5r,6s)-3-carbamimidamido-2,4,5,6-tetrahydroxycyclohexyl]guanidine
C8H18N6O4 (262.13894680000004)
methyl 2,5,9-trimethyl-11-oxotricyclo[6.3.0.0¹,⁵]undec-3-ene-3-carboxylate
methyl 2-(8-formyl-4a-methyl-2,3,4,5,6,8a-hexahydro-1h-naphthalen-2-yl)prop-2-enoate
methyl 5-[(2s,5e)-2,6-dimethylocta-5,7-dien-1-yl]furan-3-carboxylate
methyl (1r,2s,5r,8r,9s)-2,5,9-trimethyl-11-oxotricyclo[6.3.0.0¹,⁵]undec-3-ene-3-carboxylate
6-[(1r)-1-ethoxyethyl]-7-methoxy-2,2-dimethylchromene
3-methyl-2,6,9-trimethylidene-octahydro-3h-azuleno[4,5-b]furan-4,8-diol
4-isopropyl-7-methoxy-6-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
methyl 2-(7-hydroxy-4a-methyl-8-methylidene-1,2,3,4,7,8a-hexahydronaphthalen-2-yl)prop-2-enoate
methyl 2-[(2r,4ar,8ar)-8-formyl-4a-methyl-2,3,4,5,6,8a-hexahydro-1h-naphthalen-2-yl]prop-2-enoate
1-[(1r,3r,6r,8s,9s)-8-methoxy-4-methyl-7-oxatricyclo[4.3.0.0³,⁹]non-4-en-9-yl]-4-methylpent-3-en-2-one
methyl 2-[(2r,4as,7s,8ar)-7-hydroxy-4a-methyl-8-methylidene-1,2,3,4,7,8a-hexahydronaphthalen-2-yl]prop-2-enoate
5,5,12,12-tetramethyl-4,11-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1(10),2,8-trien-2-ol
methyl 4,4,8-trimethyl-7-oxocycloundeca-1,5,8-triene-1-carboxylate
methyl 2-[(2r,4as,8ar)-4a,8-dimethyl-6-oxo-1,2,3,4,5,8a-hexahydronaphthalen-2-yl]prop-2-enoate
(3ar,4as,8ar,9ar)-8a-methyl-2,3,5-trimethylidene-hexahydro-3ah-naphtho[2,3-b]furan-4a-peroxol
2-methoxy-3,5-dimethyl-6-(4-methylhepta-2,4-dien-2-yl)pyran-4-one
1-(3-methylbut-2-en-1-yl)-3-(3-methylbuta-1,3-dien-1-ylidene)-7-oxabicyclo[4.1.0]heptane-2,5-diol
n-[(1r,3s,4r,6s)-3-carbamimidamido-2,4,5,6-tetrahydroxycyclohexyl]guanidine
C8H18N6O4 (262.13894680000004)