Exact Mass: 372.18311680000005
Exact Mass Matches: 372.18311680000005
Found 500 metabolites which its exact mass value is equals to given mass value 372.18311680000005
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
galbelgin
Galgravin is a member of the class of aryltetrahydrofurans carrying two 3,4-dimethoxyphenyl substituents at positions 2 and 5 as well as two methyl groups at positions 3 and 4. It has a role as a bone density conservation agent, a neuroprotective agent, a platelet aggregation inhibitor and a plant metabolite. It is an aryltetrahydrofuran, a dimethoxybenzene, a ring assembly and a lignan. Galgravin is a natural product found in Schisandra propinqua, Piper mullesua, and other organisms with data available. A member of the class of aryltetrahydrofurans carrying two 3,4-dimethoxyphenyl substituents at positions 2 and 5 as well as two methyl groups at positions 3 and 4. Veraguensin is a lignan. It has a role as a metabolite. Veraguensin is a natural product found in Ocotea foetens, Illicium floridanum, and other organisms with data available. A natural product found in Acorus gramineus. Veraguensin is a lignan compound derived from Magnolia sp.. Veraguensin can inhibit bone resorption[1] Veraguensin is a lignan compound derived from Magnolia sp.. Veraguensin can inhibit bone resorption[1]
Biocytin
C16H28N4O4S (372.18311680000005)
Biocytin is a naturally occurring low molecular weight analog of biotin, and a primary source of this essential metabolite for mammals. Biotinidase acts as a hydrolase by cleaving biocytin and biotinyl-peptides, thereby liberating biotin for reutilization. Mammals cannot synthesize biotin and, therefore, derive the vitamin from dietary sources or from the endogenous turnover of the carboxylases. Free biotin can readily enter the biotin pool, whereas holocarboxylases or other biotin-containing proteins must first be degraded proteolytically to biocytin (biotinyl-e-lysine) or biotinyl-peptides. Biocytin is also an especially versatile marker for neuroanatomical investigations, shown that may have multiple applications, especially for labeling neurons. (PMID: 8930409, 1384763, 2479450) [HMDB] Biocytin is a naturally occurring low molecular weight analog of biotin, and a primary source of this essential metabolite for mammals. Biotinidase acts as a hydrolase by cleaving biocytin and biotinyl-peptides, thereby liberating biotin for reutilization. Mammals cannot synthesize biotin and, therefore, derive the vitamin from dietary sources or from the endogenous turnover of the carboxylases. Free biotin can readily enter the biotin pool, whereas holocarboxylases or other biotin-containing proteins must first be degraded proteolytically to biocytin (biotinyl-e-lysine) or biotinyl-peptides. Biocytin is also an especially versatile marker for neuroanatomical investigations, shown that may have multiple applications, especially for labeling neurons. (PMID:8930409, 1384763, 2479450).
Pyrethrin
D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins
Buthiobate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D007096 - Imidoesters
Tanabalin
Tanabalin is found in herbs and spices. Tanabalin is a constituent of Tanacetum balsamita (costmary). Constituent of Tanacetum balsamita (costmary). Tanabalin is found in tea and herbs and spices.
Acebutolol HCl
C18H29ClN2O4 (372.18157440000004)
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Acebutolol hydrochloride is an orally active β1 adrenergic receptor (β1AR) antagonist. Acebutolol hydrochloride is used in the treatment of hypertension, angina pectoris and cardiac arrhythmias[1][2][3].
Armillasin
Armillasin is found in mushrooms. Armillasin is a metabolite of Armillaria mellea (honey mushroom). Metabolite of Armillaria mellea (honey mushroom). Armillasin is found in mushrooms.
Mammea B/AB
Constituent of Mammea americana (mamey) seeds. Mammea B/AB is found in fruits and mammee apple. Mammea B/AB is found in fruits. Mammea B/AB is a constituent of Mammea americana (mamey) seeds
Mammea B/BA
Mammea B/BA is found in fruits. Mammea B/BA is a constituent of Mammea americana (mamey) seeds
Isomammein
Isomammein is found in fruits. Isomammein is a constituent of Mammea americana (mamey) seeds
(S)-Neomammein
(S)-Neomammein is found in fruits. (S)-Neomammein is a constituent of Mammea americana (mamey) seeds. Constituent of Mammea americana (mamey) seeds. (S)-Neomammein is found in fruits.
6-Methylprednisone
1,4-Dihydro-2-methylbenzoicacid
Androstane-3,17-diol 17-sulfate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Betalone
Diamfenetide
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Medroxalol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
Pyroglutamyl-phenylalanyl-prolinamide
Zotiraciclib
C23H24N4O (372.19500139999997)
(8S,9S,10S,13S,14S,17R)-17-Hydroxy-17-(2-hydroxyacetyl)-1,10,13-trimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)propane
MEDROXALOL
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
2,4-Di-Me ether,1-O-beta-D-glucopyranoside-6-(1-Methylpropyl)-1,2,4-benzenetriol
2beta-hydroxy-3,12-dioxo-23,24-dinorchola-4,6-dienoic acid
2,6-dimethyl-3-hydroxymethyl-5-oxo-1,6-heptadiene-9-O-(6-acetyl-beta-D-glucopyranoside)
3-(4-acetoxyprenyl)-5-prenyl-7E-p-coumaric acid-4-O-methyl ether|3-<4-acetoxyprenyl>-5-prenyl-7E-p-coumaric acid-4-O-methyl ether
3,16-Di-Ac-(16beta,17betaOH)-Estra-1,3,5(10)-triene-3,16,17-triol
5??-p-Hydroxybenzoyloxydauc-2-ene-1-one|6alpha-p-hydroxybenzoyloxy-4beta-hydroxydauc-8-ene-10-one
4-hydroxy-2-(3-hydroxy-3-methylbutyl)-5-methylphenyl beta-D-glucopyranoside|4-Hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenyl ??-D-glucopyranoside
(3S)-3-hydroxysedanolide beta-D-glucopyranoside|celephthalide C
5,5,6-Trimethyl-6-(1,2,3-triacetoxy-butyl)-tetrahydro-pyran-2-on|5,5,6-trimethyl-6-(1,2,3-triacetoxy-butyl)-tetrahydro-pyran-2-one
Lehualide J
A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by methoxy groups at positions 3 and 4, a methyl group at position 5 and a 10-(methylsulfinyl)decyl group at position 6. It has been isolated from the marine sponge of the genus Plakortis.
5-(6-hydroxyhexyl)benzene-1,3-diol 1-O-beta-D-glucopyranoside|5-(6-hydroxyhexyl)resorcinol 1-O-beta-D-glucopyranoside|grevilloside H
5-Allyl-1,3-dimethoxy-2-[[1-methyl-2-(3,4-dimethoxyphenyl)ethyl]oxy]benzene
1-(2,6-DIHYDROXYPHENYL)-9-(4-HYDROXY-3-METHOXYPHENYL)NONAN-1-ONE
2-(2,5-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)tetrahydro-3,4-dimethylfuran
20-Ac-9,20-Dihydroxy-1,6,14-rhamnofolatriene-3,13-dione|20-Acetoxy-9-hydroxy-13,15-seco-4alpha-tiglia-1,6,14-trien-3,13-dion|9alpha-Hydroxy-20-acetoxy-13.15-seco-Delta1.6.14-4alpha.10alpha-tigliatrien-3.13-dion
3-Hydroxy-6,7-dimethoxy-2,3-dimethyl-1-(3,4-dimethoxy-phenyl)-tetralin|3-Hydroxy-6,7-dimethoxy-2,3-dimethyl-1-(3,4-dimethoxyphenyl)-tetralin
1-Aldehyde,8-O-(2-acetyl-beta-D-glucopyranoside)-(E)-2-Methyl-6-methylene-2-octene-1,8-diol|7-Formyl-3-methylene-6E-octenol-O-beta-D-(2-O-acetylglucopyranoside)|7-Formyl-3-methylene-6E-octenol-O-beta-D-<2-O-acetylglucopyranoside>
(1E,6E,12E)-18-acetoxy-19-oxoxenica-1(9),6,12,14-tetraen-17,18-olide
2,11beta-Dimethoxy-19-nor-17alpha-pregna-1,3,5(10)trien-20-yn-3,16beta,17beta-triol
2,5-bis(3,4-dimethoxyphenyl)-3,4-dimethyloxolane
1,2,3-trimethoxy-5-[2-(2-methoxy-4-prop-2-enylphenoxy)propyl]benzene
(2R,3S,4S,5R)-2,5-bis(3,4-dimethoxyphenyl)-3,4-dimethyloxolane
C20H24N2O5_3-Pyridinecarboxylic acid, 1,4-dihydro-6-(hydroxyphenylmethyl)-1-[2-[(3-methyl-1-oxobutyl)amino]ethyl]-4-oxo
Biocytin
C16H28N4O4S (372.18311680000005)
A monocarboxylic acid amide that results from the formal condensation of the carboxylic acid group of biotin with the N(6)-amino group of L-lysine.
Veraguensin
Veraguensin is a lignan compound derived from Magnolia sp.. Veraguensin can inhibit bone resorption[1] Veraguensin is a lignan compound derived from Magnolia sp.. Veraguensin can inhibit bone resorption[1]
Ala Ala Asp Pro
Ala Ala Pro Asp
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Ala Val Ser Pro
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Asp Ala Pro Ala
Asp Pro Ala Ala
Glu Ala Gly Pro
Glu Pro Gly Ala
Gly Ala Glu Pro
Gly Ala Pro Glu
Gly Glu Ala Pro
Gly Glu Pro Ala
Gly Ile Pro Ser
Gly Ile Ser Pro
Gly Leu Pro Ser
Gly Leu Ser Pro
Gly Pro Ala Glu
Gly Pro Glu Ala
Gly Pro Ile Ser
Gly Pro Leu Ser
Gly Pro Ser Ile
Gly Pro Ser Leu
Gly Pro Thr Val
Gly Pro Val Thr
Gly Ser Ile Pro
Gly Ser Leu Pro
Gly Ser Pro Ile
Gly Ser Pro Leu
Gly Thr Pro Val
Gly Thr Val Pro
Gly Val Pro Thr
Gly Val Thr Pro
Ile Gly Pro Ser
Ile Gly Ser Pro
Ile Pro Gly Ser
Ile Pro Ser Gly
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Leu Gly Pro Ser
Leu Gly Ser Pro
Leu Pro Gly Ser
Leu Pro Ser Gly
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Leu Ser Pro Gly
Pro Ala Ala Asp
Pro Ala Asp Ala
Pro Ala Glu Gly
Pro Ala Gly Glu
Pro Ala Ser Val
Pro Ala Val Ser
Pro Asp Ala Ala
Pro Glu Ala Gly
Pro Glu Gly Ala
Pro Gly Ala Glu
Pro Gly Glu Ala
Pro Gly Ile Ser
Pro Gly Leu Ser
Pro Gly Ser Ile
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Pro Gly Val Thr
Pro Ile Gly Ser
Pro Ile Ser Gly
Pro Leu Gly Ser
Pro Leu Ser Gly
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Pro Ser Gly Ile
Pro Ser Gly Leu
Pro Ser Ile Gly
Pro Ser Leu Gly
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Pro Thr Val Gly
Pro Val Ala Ser
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Ser Ala Pro Val
Ser Ala Val Pro
Ser Gly Ile Pro
Ser Gly Leu Pro
Ser Gly Pro Ile
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Ser Leu Gly Pro
Ser Leu Pro Gly
Ser Pro Ala Val
Ser Pro Gly Ile
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Val Thr Pro Gly
(2R,3R,4S,5S)-2,5-bis(3,4-dimethoxyphenyl)-3,4-dimethyltetrahydrofuran
16-phenyl-tetranor-PGE2
(-)-20-Acetoy-9-hydroxy-1,6,14-rhamnofolane-triene-3,13-dione
Isomammein
MAB 2
Mammein
Armillasin
(S)-Neomammein
Tanabalin
pyrethrin II
D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins
1-amino-5-(trityloxymethyl)pyrrolidin-2-one
C24H24N2O2 (372.18376839999996)
[1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-(1-piperidinylcarbonyl) -1H-indol-2-yl]boronic acid
Fentanyl Hydrochloride
C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist
benzoic acid,2,2-dimethylpropane-1,3-diol,hexanedioic acid
bis(trimethylsilyl)bisphenol a
C21H32O2Si2 (372.19407319999993)
meprednisone
H - Systemic hormonal preparations, excl. sex hormones and insulins > H02 - Corticosteroids for systemic use > H02A - Corticosteroids for systemic use, plain > H02AB - Glucocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
1-Decyl-3-Methylimidazolium Triflate
C15H27F3N2O3S (372.16943879999997)
17beta-Estradiol hemisuccinate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Zotiraciclib
C23H24N4O (372.19500139999997)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclopentyl-N-[(tetrahydro-2-furanyl)methyl]- (9CI)
N,N-(Methylene-p-phenylene)-bis-[N-(2-hydroxyethyl)]urea
1,3-Propanediol,2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-
N-[(1R)-1-Hydroperoxy-3-methylbutyl]-Nα-(2-pyrazinylcarbonyl)-L-phenylalaninamide
N-[(1S)-1-Hydroperoxy-3-methylbutyl]-Nα-(2-pyrazinylcarbonyl)-L-phenylalaninamide
(2R,3R)-3-(tert-butyl)-4-(2,6-dimethoxyphenyl)-2-isopropyl-2,3-dihydrobenzo[d][1,3]oxaphosphole
C22H29O3P (372.18542140000005)
(2S,3S)-3-(tert-butyl)-4-(2,6-dimethoxyphenyl)-2-isopropyl-2,3-dihydrobenzo[d][1,3]oxaphosphole
C22H29O3P (372.18542140000005)
N-Cbz-L-lysine tert-butyl ester hydrochloride
C18H29ClN2O4 (372.18157440000004)
Carbamic acid, (5-(2-deoxy-beta-D-erythro-pentofuranosyl)-1,4,5,6-tetrahydro-4-oxo-1,3,5-triazin-2-yl)-, heptyl ester
Prednylidene
H - Systemic hormonal preparations, excl. sex hormones and insulins > H02 - Corticosteroids for systemic use > H02A - Corticosteroids for systemic use, plain > H02AB - Glucocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
N-Acetyl-leucyl-phenylalanyl trifluoromethyl ketone
(R)-2-Amino-3-((3-octylphenyl)amino)-3-oxopropyl dihydrogen phosphate
C17H29N2O5P (372.18139940000003)
D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents > D000081243 - Sphingosine 1 Phosphate Receptor Modulators
2-[[1-Oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]-5-isoquinolinyl]oxy]acetic acid ethyl ester
5-[(3r)-3-(5-Methoxy-4-Methylbiphenyl-3-Yl)but-1-Yn-1-Yl]-6-Methylpyrimidine-2,4-Diamine
C23H24N4O (372.19500139999997)
6-[N-(4-Ethyl-1,2,3,4-tetrahydro-6-isoquinolinyl)carbamyl]-2-naphthalenecarboxamidine
C23H24N4O (372.19500139999997)
5-(2-Aminoethyl)-3-{5-[amino(iminio)methyl]-1H-benzimidazol-2-YL}-1,1-biphenyl-2-olate
1,2,3-Trimethoxy-5-[2-(2-methoxy-4-prop-2-enylphenoxy)propyl]benzene
2-(cyclopropylmethylamino)-N-(2-phenylethyl)-5-pyridin-3-ylpyridine-3-carboxamide
C23H24N4O (372.19500139999997)
Biocytin zwitterion
C16H28N4O4S (372.18311680000005)
An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of biocytin; major species at pH 7.3.
7-O-acetylsalutaridinol(1+)
C21H26NO5+ (372.18108860000007)
The conjugate acid of 7-O-acetylsalutaridinol arising from protonation of the tertiary amino function.
methyl-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]azanium
C21H26NO5+ (372.18108860000007)
(8S,9S,10S,13S,14S,17R)-17-Hydroxy-17-(2-hydroxyacetyl)-1,10,13-trimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione
Gelomulide K
An abietane diterpenoid that is ent-abieta-2(3),13(15)-diene-16,12-olide substituted by a 1beta-acetoxy group and a beta-epoxy group across positions 8 and 14. Isolated from the leaves of Gelonium aequoreum, it exhibits moderate cytotoxicity against lung (A549), breast (MDAMB-231 and MCF7), and liver (HepG2) cancer cell lines.
4-[[(3,4-Dimethoxyanilino)-oxomethyl]amino]benzoic acid butyl ester
4-[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-N-(5-methyl-3-isoxazolyl)-4-oxobutanamide
N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-2-pyrazinecarboxamide
N-(2-methoxyphenyl)-4,6-bis(4-morpholinyl)-1,3,5-triazin-2-amine
C18H24N6O3 (372.19097939999995)
5alpha-Androstane-3alpha,17beta-diol 17-monosulfate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
17beta-(Acetylthio)estra-1,3,5(10)-trien-3-ol acetate
(1S,5R)-3-[(2-fluorophenyl)methyl]-7-[4-(4-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
C25H25FN2 (372.20016619999996)
(1S,5R)-3-[(3-fluorophenyl)methyl]-7-[4-(3-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
C25H25FN2 (372.20016619999996)
(1R,5S)-6-[(3-fluorophenyl)methyl]-7-[4-(3-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
C25H25FN2 (372.20016619999996)
(1R,5S)-6-[(2-fluorophenyl)methyl]-7-[4-(4-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
C25H25FN2 (372.20016619999996)
5alpha-Androstane-3alpha,17beta-diol 3-monosulfate
(1S,5R)-7-[4-[(Z)-prop-1-enyl]phenyl]-6-[[2-(trifluoromethyl)phenyl]methyl]-3,6-diazabicyclo[3.1.1]heptane
(4Z)-2-Ethyl-4-[(4-ethylphenyl)methylidene]-1,3-dihydrobenzo[b][1,6]naphthyridine-10-carboxylic acid
C24H24N2O2 (372.18376839999996)
(2S)-2-amino-6-[[4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-1-ium-2-yl]amino]hexanoic acid
2,3-Dihydroxypropyl (2-hydroxy-3-nonoxypropyl) hydrogen phosphate
C15H33O8P (372.19129480000004)
(3S)-3-(Tert-butyldimethylsilyloxy)-5-tosylpentanol
(1S,2S,3E,7S,8R,10E,12Z)-7-Acetoxy-8,11-epoxycembra-3,10,12,15-tetraen-17,2-olide
5,7-dihydroxy-8-(3-methylbut-2-enyl)-6-(3-methylbutanoyl)-4-propyl-2H-chromen-2-one
A natural product found in Mammea americana.
3-hydroxy-5-pentylphenyl 2-hydroxy-4-methoxy-6-propylbenzoate
(1r,4as,10ar)-7-[2-(acetyloxy)propan-2-yl]-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2h-phenanthrene-1-carboxylic acid
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-5-methyl-4-oxo-2-(prop-1-en-2-yl)hex-5-en-1-yl]oxy}oxan-2-yl]methyl acetate
(3r,3as,4s,8ar)-3-hydroxy-3-isopropyl-6,8a-dimethyl-1-oxo-3a,4,5,8-tetrahydro-2h-azulen-4-yl 4-hydroxybenzoate
(1s)-2-[(6ar,7s,8r,10as)-7,8-dimethyl-3-oxo-1h,5h,6h,6ah,8h,9h,10h-naphtho[4,4a-c]furan-7-yl]-1-(furan-3-yl)ethyl acetate
(4s)-4-[(2r)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4,5-dimethoxy-2-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-one
(3r,3as,4s,8r,8as)-3,8-dihydroxy-3-isopropyl-6,8a-dimethyl-7-oxo-2,3a,4,8-tetrahydro-1h-azulen-4-yl benzoate
3-[3-hydroxy-1-methoxy-1-(2-methylpropyl)-6-oxo-4h-pyrazino[2,1-b]quinazolin-4-yl]propanimidic acid
(3as,5ar,6s)-6-(acetyloxy)-8-formyl-1-isopropyl-5a-methyl-2h,3h,4h,5h,6h,7h-cyclohepta[e]indene-3a-carboxylic acid
[(1s,3r,10s,11r,16r)-11,15,15-trimethyl-6-oxo-2,7-dioxapentacyclo[8.8.0.0¹,³.0⁴,⁸.0¹¹,¹⁶]octadeca-4,8-dien-5-yl]methyl acetate
(2e)-3-{3-[(2z)-3-[(acetyloxy)methyl]-7-methylocta-2,6-dien-1-yl]-4-methoxyphenyl}prop-2-enoic acid
n-{6-[hydroxy(phenyl)methyl]-1-(2-hydroxyethyl)-4-oxopyridine-3-carbonyl}-3-methylbutanimidic acid
4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
(2r,3s)-1,4-bis(3,4-dimethoxyphenyl)-2,3-dimethylbutan-1-one
2-methoxy-3,5-dimethyl-6-[1,3,6-trimethyl-2-oxo-4-(3-oxopent-1-en-2-yl)bicyclo[3.1.0]hexan-6-yl]pyran-4-one
15-acetoxy-7-oxo-dehydroabieticacid
{"Ingredient_id": "HBIN001602","Ingredient_name": "15-acetoxy-7-oxo-dehydroabieticacid","Alias": "NA","Ingredient_formula": "C22H28O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "271","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
17-acetoxyjolkinolide a
{"Ingredient_id": "HBIN001981","Ingredient_name": "17-acetoxyjolkinolide a","Alias": "NA","Ingredient_formula": "C22H28O5","Ingredient_Smile": "CC(=O)OCC1=C2C3C4(O3)CCC5C(CCCC5(C4C=C2OC1=O)C)(C)C","Ingredient_weight": "372.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "245","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11793652","DrugBank_id": "NA"}
4-(2,6,6- trimethyl-1- cyclohexen-1- yl)-3- buten-2- on
{"Ingredient_id": "HBIN009861","Ingredient_name": "4-(2,6,6- trimethyl-1- cyclohexen-1- yl)-3- buten-2- on","Alias": "NA","Ingredient_formula": "C19H24N4O4","Ingredient_Smile": "CC1=CCCC(C1C=CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42888","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenylβ-d-glucopyranoside
{"Ingredient_id": "HBIN010435","Ingredient_name": "4-hydroxy-2-[3-hydroxy-3-methylbutyl]-5-methylphenyl\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C18H28O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10199","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5α-p-hydroxybenzoyloxydauc-2-ene-1-one
{"Ingredient_id": "HBIN011432","Ingredient_name": "5\u03b1-p-hydroxybenzoyloxydauc-2-ene-1-one","Alias": "NA","Ingredient_formula": "C22H28O5","Ingredient_Smile": "CC1=CC(=O)C2(CCC(C2C(C1)OC(=O)C3=CC=C(C=C3)O)(C(C)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9828","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-2-{[(2s)-2-amino-1-hydroxy-5-[(1-hydroxyethylidene)amino]pentylidene]amino}-3-hydroxy-3-[(3r,5s)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl]propanoic acid
(2e)-n-{4-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]butyl}-3-(4-hydroxy-3-methoxyphenyl)prop-2-enimidic acid
n-[1-(8-hydroxy-1-oxo-3,4-dihydro-2-benzopyran-3-yl)-3-methylbutyl]-2-(5-hydroxy-3,4-dihydropyrrol-2-ylidene)ethanimidic acid
2-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-7-en-16-yl acetate
n-{6-[(s)-hydroxy(phenyl)methyl]-1-(2-hydroxyethyl)-4-oxopyridine-3-carbonyl}-3-methylbutanimidic acid
7-[2-(acetyloxy)propan-2-yl]-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2h-phenanthrene-1-carboxylic acid
5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-6-[(2r)-2-methylbutanoyl]-4-propylchromen-2-one
(1's,3s,4's,7'r,8's,11'r)-6'-ethyl-11'-hydroxy-1,6-dimethoxy-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0⁴,⁸]undecan]-5'-en-2-one
16-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-7-en-2-yl acetate
(1s)-2-methyl-4-oxo-3-[(2e)-penta-2,4-dien-1-yl]cyclopent-2-en-1-yl (1r,3r)-3-[(1z)-3-methoxy-2-methyl-3-oxoprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate
3-[(1r,4s)-1-tert-butyl-3-hydroxy-1-methoxy-6-oxo-4h-pyrazino[2,1-b]quinazolin-4-yl]propanimidic acid
(1s,3r,9r)-9-methyl-10-oxo-7-[(1r)-1,3,3-trimethylcyclohexyl]-2,11-dioxatricyclo[6.3.1.0⁴,¹²]dodeca-4(12),5,7-trien-3-yl acetate
(4r)-4-[(2r)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4,5-dimethoxy-2-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-one
(2s,3s)-1,4-bis(3,4-dimethoxyphenyl)-2,3-dimethylbutan-1-one
3-{3-[4-(acetyloxy)-3,7-dimethylocta-2,6-dien-1-yl]-4-methoxyphenyl}prop-2-enoic acid
methyl 2-[(1r,3r,4s,5s,7r,10s,11s,15s)-4,11,15-trimethyl-8,9-dioxo-16-oxahexacyclo[8.5.1.1⁴,⁷.0¹,⁷.0³,⁵.0¹⁰,¹⁵]heptadecan-11-yl]acetate
(1r,6s,9s,10s,14s,16r,17r,18s,19s)-9,17,18,19-tetrahydroxy-14-methyl-3,15,20-trioxatricyclo[14.3.1.0⁶,¹⁰]icos-12-en-4-one
(1s,2s,3r,4r)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
(2s,3r,4s,5s,6r)-2-[4-hydroxy-2-(3-hydroxy-3-methylbutyl)-5-methylphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(2s)-2-[(1r,3as,3br,8s,9ar,9bs,11as)-8-hydroxy-9a,11a-dimethyl-7,11-dioxo-1h,2h,3h,3ah,3bh,8h,9h,9bh,10h-cyclopenta[a]phenanthren-1-yl]propanoic acid
2-[(2s,4as,4br,8r,8ar)-8-hydroxy-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1h-phenanthren-2-yl]ethoxysulfonic acid
(1r,2s,3s,4r)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
(4r,5r,14r)-8-hydroxy-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-14-propyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-triene-6,12-dione
(4r,5s)-8-hydroxy-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-14-propyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-triene-6,12-dione
(2z)-3-{3-[(2e,4r)-4-(acetyloxy)-3,7-dimethylocta-2,6-dien-1-yl]-4-methoxyphenyl}prop-2-enoic acid
[10a-hydroxy-2,10-dimethyl-3,8-dioxo-7-(propan-2-ylidene)-3ah,4h,6ah,9h,10h,10bh-cyclohexa[e]azulen-5-yl]methyl acetate
[(3ar,6as,10r,10as,10br)-10a-hydroxy-2,10-dimethyl-3,8-dioxo-7-(propan-2-ylidene)-3ah,4h,6ah,9h,10h,10bh-cyclohexa[e]azulen-5-yl]methyl acetate
(1s,2r,4s,9r,10s,13s,16r)-16-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-7-en-2-yl acetate
9-(5-{[(1-hydroxy-3-methylbutylidene)amino]carbonyl}-4-oxo-1h-pyridin-2-yl)nona-2,4,8-trienoic acid
2-[(2e,6z)-7-carboxy-3-methyl-7-(4-methylpent-3-en-1-yl)hepta-2,6-dien-1-yl]-4-hydroxybenzoic acid
6-(acetyloxy)-8-formyl-1-isopropyl-5a-methyl-2h,3h,4h,5h,6h,7h-cyclohepta[e]indene-3a-carboxylic acid
2-[(acetyloxy)methyl]-6-[2-(furan-3-yl)ethyl]-5,6-dimethylcyclodeca-1,7,9-triene-1-carboxylic acid
3-[(2r,3s)-2,3,8,8-tetramethyl-4-oxo-2h,3h-pyrano[2,3-f]chromen-6-yl]hexanoic acid
(3r,3as)-3-[(3s)-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl]-3a,4,5,6-tetrahydro-3h-2-benzofuran-1-one
(2s,3r,4s,5s,6r)-2-[3-hydroxy-5-(6-hydroxyhexyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
2-methoxy-3,5-dimethyl-6-[(1s,3r,4r,5s,6s)-1,3,6-trimethyl-2-oxo-4-(3-oxopent-1-en-2-yl)bicyclo[3.1.0]hexan-6-yl]pyran-4-one
(5r)-6,6-dimethyl-5-(3-oxobutyl)-10-pentyl-2,7-dioxatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraene-11-carboxylic acid
8-hydroxy-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-14-propyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-triene-6,12-dione
(1s)-2-[(6as,7s,8r,10as)-7,8-dimethyl-3-oxo-1h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-7-yl]-1-(furan-3-yl)ethyl acetate
(2r,2ar,4as,6r,7ar,7br)-3-(hydroxymethyl)-6,7b-dimethyl-1h,2h,2ah,4ah,5h,6h,7h,7ah-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate
9-methyl-10-oxo-7-(1,3,3-trimethylcyclohexyl)-2,11-dioxatricyclo[6.3.1.0⁴,¹²]dodeca-4(12),5,7-trien-3-yl acetate
(3,4,5-trihydroxy-6-{[5-methyl-4-oxo-2-(prop-1-en-2-yl)hex-5-en-1-yl]oxy}oxan-2-yl)methyl acetate
(1s,4s,5s,10s,12r,14s)-5-methyl-16-methylidene-8,15-dioxo-4-(prop-1-en-2-yl)-9-oxatetracyclo[10.2.2.0¹,¹⁰.0⁵,¹⁰]hexadecan-14-yl acetate
(1r,2r,4s,9r,10s,13s,16r)-2-hydroxy-5,5,9-trimethyl-14-methylidene-6,15-dioxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-7-en-16-yl acetate
(1r,2s,7s,8ar)-7-[(1e)-1-methoxy-3-oxoprop-1-en-2-yl]-1,8a-dimethyl-6-oxo-1,2,7,8-tetrahydronaphthalen-2-yl (4e)-hex-4-enoate
(1e,5r,6s,7e,9z)-2-[(acetyloxy)methyl]-6-[2-(furan-3-yl)ethyl]-5,6-dimethylcyclodeca-1,7,9-triene-1-carboxylic acid
(5s)-5-(2,5-dihydroxyphenyl)-3-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-5-methoxyfuran-2-one
3-(hydroxymethyl)-6,7b-dimethyl-1h,2h,2ah,4ah,5h,6h,7h,7ah-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate
5-formyl-10-hydroxy-5-methyl-11-methylidene-15-oxopentacyclo[10.3.2.0¹,⁶.0⁹,¹⁴.0⁹,¹⁶]heptadecan-8-yl acetate
(1s,5e)-1-[(2z)-oct-2-en-1-yl]-4-oxo-5-[(2z)-3-[(2s)-5-oxooxolan-2-yl]prop-2-en-1-ylidene]cyclopent-2-en-1-yl acetate
1,4-bis(3,4-dimethoxyphenyl)-2,3-dimethylbutan-1-one
2-[4-hydroxy-2-(3-hydroxy-3-methylbutyl)-5-methylphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
5-(2,5-dihydroxyphenyl)-3-[(3e,6e)-8-methoxy-4,8-dimethylnona-3,6-dien-1-yl]-5h-furan-2-one
(3r,3as,4s,8ar)-6-formyl-3-hydroxy-3-isopropyl-8a-methyl-1,2,3a,4,5,8-hexahydroazulen-4-yl 4-hydroxybenzoate
(4br,8ar)-3,8a-dimethoxy-4b,8,8-trimethyl-2-(prop-1-en-2-yl)-6,7,9,10-tetrahydrophenanthrene-1,4,5-trione
3-(3-{3-[(acetyloxy)methyl]-7-methylocta-2,6-dien-1-yl}-4-methoxyphenyl)prop-2-enoic acid
(2e)-3-{3-[(2e,4r)-4-(acetyloxy)-3,7-dimethylocta-2,6-dien-1-yl]-4-methoxyphenyl}prop-2-enoic acid
(4ar,5s,6r,8as)-8a-[(acetyloxy)methyl]-5-[2-(furan-3-yl)ethyl]-5,6-dimethyl-4a,6,7,8-tetrahydronaphthalene-1-carboxylic acid
(2z)-3-{3-[(2z)-3-[(acetyloxy)methyl]-7-methylocta-2,6-dien-1-yl]-4-methoxyphenyl}prop-2-enoic acid
3-methoxy-5-propylphenyl 2,4-dihydroxy-6-pentylbenzoate
n-{4-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]butyl}-3-(4-hydroxy-3-methoxyphenyl)prop-2-enimidic acid
(4s)-4-[1-(3,4-dimethoxyphenyl)propan-2-yl]-4,5-dimethoxy-2-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-one
(4r,5s,14s)-8-hydroxy-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-14-propyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-triene-6,12-dione
(2s,3r)-2-{[(2r)-2-amino-1-hydroxy-5-[(1-hydroxyethylidene)amino]pentylidene]amino}-3-hydroxy-3-[(3s,5r)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl]propanoic acid
(2s,3s,4s,5s)-2,5-bis(3,4-dimethoxyphenyl)-3,4-dimethyloxolane
2-(8-hydroxy-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1h-phenanthren-2-yl)ethoxysulfonic acid
2-{[(1s,4ar,8as)-5,5,8a-trimethyl-2-methylidene-6-oxo-hexahydronaphthalen-1-yl]methyl}-3-hydroxy-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione
4-[1-(3,4-dimethoxyphenyl)propan-2-yl]-4,5-dimethoxy-2-(prop-2-en-1-yl)cyclohexa-2,5-dien-1-one
methyl (2z,5e)-2-[2-(2,5-dihydroxyphenyl)-2-oxoethylidene]-6,10-dimethylundeca-5,9-dienoate
3-[(1r,4s)-3-hydroxy-1-methoxy-1-(2-methylpropyl)-6-oxo-4h-pyrazino[2,1-b]quinazolin-4-yl]propanimidic acid
2-amino-4-{[1-(3,5-dimethoxy-2-methyl-6-oxocyclohex-1-en-1-yl)-1-hydroxypropan-2-yl]-c-hydroxycarbonimidoyl}butanoic acid
(1r)-2-[(6as,7s,8r,10as)-7,8-dimethyl-3-oxo-1h,5h,6h,6ah,8h,9h,10h-naphtho[1,8a-c]furan-7-yl]-1-(furan-3-yl)ethyl acetate
7-(1-methoxy-3-oxoprop-1-en-2-yl)-1,8a-dimethyl-6-oxo-1,2,7,8-tetrahydronaphthalen-2-yl hex-4-enoate
(4s,5r,14s)-8-hydroxy-14-isopropyl-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-triene-6,12-dione
2-methyl-4-oxo-3-[(2z)-penta-2,4-dien-1-yl]cyclopent-2-en-1-yl (1r,3r)-3-[(1e)-3-methoxy-2-methyl-3-oxoprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylate
(1s,3s,9r)-9-methyl-10-oxo-7-[(1s)-1,3,3-trimethylcyclohexyl]-2,11-dioxatricyclo[6.3.1.0⁴,¹²]dodeca-4(12),5,7-trien-3-yl acetate
(7e)-2-[(acetyloxy)methyl]-6-[2-(furan-3-yl)ethyl]-5,6-dimethylcyclodeca-1,7,9-triene-1-carboxylic acid
(1z,5r,6s,7e,9z)-2-[(acetyloxy)methyl]-6-[2-(furan-3-yl)ethyl]-5,6-dimethylcyclodeca-1,7,9-triene-1-carboxylic acid
3-methoxy-2,5,6-trimethylphenyl 2,4-dimethoxy-3,5,6-trimethylbenzoate
5-(2,5-dihydroxyphenyl)-3-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-5-methoxyfuran-2-one
(3r,5r)-8-decyl-3,4-dihydroxy-2,6-dioxo-1,7-dioxaspiro[4.4]nonane-4-carboxylic acid
(2s)-2-amino-4-{[(1r,2s)-1-[(3s,5s)-3,5-dimethoxy-2-methyl-6-oxocyclohex-1-en-1-yl]-1-hydroxypropan-2-yl]-c-hydroxycarbonimidoyl}butanoic acid
(4r,5s,14r)-8-hydroxy-4,5-dimethyl-9-(3-methylbut-2-en-1-yl)-14-propyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-triene-6,12-dione
(6s,12bs)-4,12-dihydroxy-3,10,11-trimethoxy-6-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphen-6-ium
[C21H26NO5]+ (372.18108860000007)
5-(2,5-dihydroxyphenyl)-3-(4,8-dimethylnona-3,7-dien-1-yl)-5-methoxyfuran-2-one
n-[(1s)-1-[(3s)-8-hydroxy-1-oxo-3,4-dihydro-2-benzopyran-3-yl]-3-methylbutyl]-2-[(2z)-5-hydroxy-3,4-dihydropyrrol-2-ylidene]ethanimidic acid
1,6,13-trimethyl-9,12-dioxo-11-oxapentacyclo[8.6.1.1⁵,⁸.0²,⁸.0¹³,¹⁷]octadec-10(17)-en-6-yl acetate
9,17,18,19-tetrahydroxy-14-methyl-3,15,20-trioxatricyclo[14.3.1.0⁶,¹⁰]icos-12-en-4-one
6,6-dimethyl-5-(3-oxobutyl)-10-pentyl-2,7-dioxatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraene-11-carboxylic acid
5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-8-[(2r)-2-methylbutanoyl]-4-propylchromen-2-one
1-[1-(acetyloxy)-7-methyl-11-methylidene-1h,4ah,5h,6h,9h,10h,11ah-cyclonona[c]pyran-4-yl]buta-2,3-dien-1-yl acetate
(3r,3as,4r,8ar)-3-hydroxy-3-isopropyl-6,8a-dimethyl-7-oxo-2,3a,4,8-tetrahydro-1h-azulen-4-yl 4-hydroxybenzoate
5,11,15,15-tetramethyl-6-oxo-2,7-dioxapentacyclo[8.8.0.0¹,³.0⁴,⁸.0¹¹,¹⁶]octadeca-4,13-dien-12-yl acetate
6'-ethyl-11'-hydroxy-1,6-dimethoxy-10'-oxa-5'-azaspiro[indole-3,2'-tricyclo[5.3.1.0⁴,⁸]undecan]-5'-en-2-one
2-[(5,5,8a-trimethyl-2-methylidene-6-oxo-hexahydronaphthalen-1-yl)methyl]-3-hydroxy-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione
{[8,11-dihydroxy-10-(sec-butyl)-2-oxa-6,9,12-triazatricyclo[13.2.2.0³,⁷]nonadeca-1(17),8,11,15,18-pentaen-6-yl]methylidyne}oxidanium
[C20H26N3O4]+ (372.19232160000007)