Exact Mass: 478.2695
Exact Mass Matches: 478.2695
Found 500 metabolites which its exact mass value is equals to given mass value 478.2695
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Dehydroemetine
P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01A - Agents against amoebiasis and other protozoal diseases C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
(1R,4R,5R,8R,9S)-9-formyl-5-methyl-13-propan-2-yl-2-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]tetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylic acid
Iloprost
Iloprost is only found in individuals that have used or taken this drug. It is a synthetic analogue of prostacyclin PGI2. Iloprost dilates systemic and pulmonary arterial vascular beds. It is used to treat pulmonary arterial hypertension (PAH).Iloprost is a second generation structural analog of prostacyclin (PGI) with about ten-fold greater potency than the first generation stable analogs, such as carbaprostacyclin. Iloprost binds with equal affinity to human prostacyclin (Prostanoid IP) and prostaglandin EP1 receptors. Iloprost constricts the ilium and fundus circular smooth muscle as strongly as prostaglandin E2 (PGE2) itself. Iloprost inhibits the ADP, thrombin, and collagen-induced aggregation of human platelets. In whole animals, iloprost acts as a vasodilator, hypotensive, antidiuretic, and prolongs bleeding time. All of these properties help to antagonize the pathological changes that take place in the small pulmonary arteries of patients with pulmonary hypertension.
Diflucortolone valerate
Mosapramine
C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics
Phenacyl 5-[(3aR,4S,5R,6aR)-5-hydroxy-4-[(3R,4S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoate
Ikarugamycin
A polyketide macrolactam containing a tetramic acid (pyrrolidine-2,4-dione) ring system. It is isolated from Streptomyces as an antibiotic with antiprotozoal and cytotoxic activities. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
Gutierrezianolic acid 3-phenylpropionate methyl ester
3-Geranyl-4,2,4,6-tetrahydroxy-5-prenyldihydrochalcone
[2-(6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2,2-dimethylpropanoate
(2R,4aR,5S,6R,6aS,10aR,10bR)-6-(acetyloxy)-4a,6a,10b-trimethyl-5-oxo-decahydro-1H-dispiro[oxirane-2,7-naphtho[2,1-b]pyran-3,3-oxolane]-5-yl 2-methylpropanoate
methyl-ent-1alpha-(2-methyl-2,3-epoxybutyryloxy)-7alpha,9alpha,15alpha-trihydroxykaur-16-en-19-oate|methyl-ent-1alpha-<2-methyl-2,3-epoxybutyryloxy>-7alpha,9alpha,15alpha-trihydroxykaur-16-en-19-oate
12-amino-6-benzyl-9-sec-butyl-15-methoxy-4,7,10-triaza-bicyclo[12.3.1]octadeca-1(18),2,14,16-tetraene-5,8,11-trione|Mucronine H
fischelactone|rel-(1aR,5S,5aR,9aR,9bR)-2,3,4,5,5a,6,9a,9b-octahydro-5,5a,7-trimethyl-9a-[(4aR,5S,9aS)-4,4a,5,6,7,8-hexahydro-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-9a(2H)-yl]-8H-oxireno[1,8a]naphtho[2,3-b]furan-8-one
ent-15beta-hydroxy-7alpha-(E)-lachnophylloyloxykaur-16-en-19-oic acid
1,6-di-O-acetyl-9-deoxyforskolin|8,13-epoxy-1alpha,6beta,7beta-triacetoxylabd-14-en-11-one
7alpha,12alpha,14beta,15beta-tetrahydroxy-3beta,19-diacetoxy-ent-kaur-16-ene 7,14-acetal|pharicinin D acetal
(1R*,4R*,5R*,6R*)-1,4,5-tris(acetyloxy)-9-{[(2Z)-2-methylbut-2-enoyl]oxy}bisabol-2(3),10(11)-diene|3-methyl-1-{2-[(1R*,2R*,5R*,6S*)-2,5,6-tris(acetyloxy)-4-methylcyclohex-3-en-1-yl]propyl}but-2-enyl (2Z)-2-methylbut-2-enoate
2,4,6,4-tetrahydroxy-3-geranyl-3-prenyl-dihydrochalcone|dihydrochalcone M-1
19-hydroxyspruceanol 19-O-beta-D-glucopyranoside|[(1R,2R,4aR,10aS)-8-ethenyl-1,2,3,4,4a,9,10,10a-octahydro-2,6-dihydroxy-1,4a,7-trimethylphenanthren-1-yl]methyl-beta-D-glucopyranoside
2,10,14-triacetoxy-7,8,18,19-diepoxydolabell-3(E)-ene|2alpha,10alpha,14alpha-triacetoxy-7,8,18,19-diepoxydolabell-3(E)-ene
bipinnatone A
A member of the class of dihydrochalones that is dihydrochalcone hydroxylated at C-2, C-4, C-6 and C-4 and substituted by a farnesyl group at C-3. It is isolated from the aerial parts of Boronia bipinnata and exhibits antimalarial activity.
methyl-3alpha-cinnamoyloxy-9beta-hydroxy-ent-kaurenoate
(2S)-2,3,9,10-tetrahydro-2-[3,4-dihydro-8-(3-hydroxy-3-methylbutyl)-2,2-dimethyl-2H-chromen-6-yl]-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one|tonkinochromane D
5alpha-hydroxy-9alpha,10beta,13alpha-triacetoxy-11(15->1)-abeo-taxa-4(20),11-diene
2beta,3alpha,15beta-Triacetoxy-7beta,8beta,14alpha,(16)-diepoxy-ent-pimarane
schweinfurthin F
A stilbenoid isolated from Macaranga alnifolia and has been shown to exhibit cytotoxic activity.
3-[3-(3,7-dimethylocta-2,6-dienyl)-4-hydroxy-5-(3-methylbut-2-enyl)phenyl]-1-(2,4,6-trihydroxyphenyl)propan-1-one
(S)-(+)-2-[3-hydroxy-4-(2-methoxy-6-methylheptan-2-yl)benzyl]-5-(3-hydroxy-5-methylphenoxy)-3-methylphenol|Expansol A
Phe Ala Asn Lys
2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
C26H38O8_(4aR,5S,6R,6aS,7R,10aR,10bR)-6-Acetoxy-4a,6a,10b-trimethyl-5-oxododecahydro-2H-dispiro[furan-3,3-benzo[f]chromene-7,2-oxiran]-5-yl 2-methylpropanoate
C26H38O8_(2E)-5-(3-Acetoxy-6-hydroxy-5,5,8a-trimethyl-2-methylene-4-oxodecahydro-1-naphthalenyl)-3-methyl-2-pentene-1,4-diyl diacetate
C26H38O8_1H-Benz[e]indene-6-propanoic acid, dodecahydro-2-hydroxy-7-(1-hydroxy-1-methylethyl)-9b-(methoxycarbonyl)-2,3a,6,9a-tetramethyl-4-methylene-1,3-dioxo
C26H38O8_1H-Naphtho[1,2-c]pyran-7-propanoic acid, dodecahydro-8-(1-hydroxy-1-methylethyl)-3-(methoxycarbonyl)-3,4a,7,10a-tetramethyl-5-methylene-1,4-dioxo
2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
Ala Phe Lys Asn
Ala Phe Asn Lys
Ala Ile Ile Tyr
Ala Ile Leu Tyr
Ala Ile Tyr Ile
Ala Ile Tyr Leu
Ala Lys Phe Asn
Ala Lys Asn Phe
Ala Leu Ile Tyr
Ala Leu Leu Tyr
Ala Leu Tyr Ile
Ala Leu Tyr Leu
Ala Asn Phe Lys
Ala Asn Lys Phe
Ala Tyr Ile Ile
Ala Tyr Ile Leu
Ala Tyr Leu Ile
Ala Tyr Leu Leu
Cys Lys Lys Thr
Cys Lys Thr Lys
Cys Thr Lys Lys
Phe Ala Lys Asn
Phe Gly Lys Gln
Phe Gly Gln Lys
Phe Ile Ile Ser
Phe Ile Leu Ser
Phe Ile Ser Ile
Phe Ile Ser Leu
Phe Ile Thr Val
Phe Ile Val Thr
Phe Lys Ala Asn
Phe Lys Gly Gln
Phe Lys Asn Ala
Phe Lys Gln Gly
Phe Leu Ile Ser
Phe Leu Leu Ser
Phe Leu Ser Ile
Phe Leu Ser Leu
Phe Leu Thr Val
Phe Leu Val Thr
Phe Asn Ala Lys
Phe Asn Lys Ala
Phe Gln Gly Lys
Phe Gln Lys Gly
Phe Ser Ile Ile
Phe Ser Ile Leu
Phe Ser Leu Ile
Phe Ser Leu Leu
Phe Thr Ile Val
Phe Thr Leu Val
Phe Thr Val Ile
Phe Thr Val Leu
Phe Val Ile Thr
Phe Val Leu Thr
Phe Val Thr Ile
Phe Val Thr Leu
Gly Phe Lys Gln
Gly Phe Gln Lys
Gly Lys Phe Gln
Gly Lys Gln Phe
Gly Gln Phe Lys
Gly Gln Lys Phe
Ile Ala Ile Tyr
Ile Ala Leu Tyr
Ile Ala Tyr Ile
Ile Ala Tyr Leu
Ile Phe Ile Ser
Ile Phe Leu Ser
Ile Phe Ser Ile
Ile Phe Ser Leu
Ile Phe Thr Val
Ile Phe Val Thr
Ile Ile Ala Tyr
Ile Ile Phe Ser
Ile Ile Ser Phe
Ile Ile Tyr Ala
Ile Leu Ala Tyr
Ile Leu Phe Ser
Ile Leu Ser Phe
Ile Leu Tyr Ala
Ile Ser Phe Ile
Ile Ser Phe Leu
Ile Ser Ile Phe
Ile Ser Leu Phe
Ile Thr Phe Val
Ile Thr Val Phe
Ile Val Phe Thr
Ile Val Thr Phe
Ile Tyr Ala Ile
Ile Tyr Ala Leu
Ile Tyr Ile Ala
Ile Tyr Leu Ala
Lys Ala Phe Asn
Lys Ala Asn Phe
Lys Cys Lys Thr
Lys Cys Thr Lys
Lys Phe Ala Asn
Lys Phe Gly Gln
Lys Phe Asn Ala
Lys Phe Gln Gly
Lys Gly Phe Gln
Lys Gly Lys Phe
Lys Gly Gln Phe
Lys Lys Cys Thr
Lys Lys Phe Gly
Lys Lys Gly Phe
Lys Lys Thr Cys
Lys Asn Ala Phe
Lys Asn Phe Ala
Lys Gln Phe Gly
Lys Gln Gly Phe
Lys Thr Cys Lys
Lys Thr Lys Cys
Leu Ala Ile Tyr
Leu Ala Leu Tyr
Leu Ala Tyr Ile
Leu Ala Tyr Leu
Leu Phe Ile Ser
Leu Phe Leu Ser
Leu Phe Ser Ile
Leu Phe Ser Leu
Leu Phe Thr Val
Leu Phe Val Thr
Leu His Ile Pro
Leu His Leu Pro
Leu His Pro Ile
Leu His Pro Leu
Leu Ile Ala Tyr
Leu Ile Phe Ser
Leu Ile His Pro
Leu Ile Pro His
Leu Ile Ser Phe
Leu Ile Tyr Ala
Leu Leu Ala Tyr
Leu Leu Phe Ser
Leu Leu His Pro
Leu Leu Pro His
Leu Leu Ser Phe
Leu Leu Tyr Ala
Leu Pro His Ile
Leu Pro His Leu
Leu Pro Ile His
Leu Ser Phe Ile
Leu Ser Phe Leu
Leu Ser Ile Phe
Leu Ser Leu Phe
Leu Thr Phe Val
Leu Thr Val Phe
Leu Val Phe Thr
Leu Val Thr Phe
Leu Tyr Ala Ile
Leu Tyr Ala Leu
Leu Tyr Ile Ala
Leu Tyr Leu Ala
Asn Ala Phe Lys
Asn Ala Lys Phe
Asn Phe Ala Lys
Asn Phe Lys Ala
Asn Lys Ala Phe
Asn Lys Phe Ala
Gln Phe Gly Lys
Gln Phe Lys Gly
Gln Gly Phe Lys
Gln Gly Lys Phe
Gln Lys Phe Gly
Gln Lys Gly Phe
Ser Phe Ile Ile
Ser Phe Ile Leu
Ser Phe Leu Ile
Ser Phe Leu Leu
Ser Ile Phe Ile
Ser Ile Phe Leu
Ser Ile Ile Phe
Ser Ile Leu Phe
Ser Leu Phe Ile
Ser Leu Phe Leu
Ser Leu Ile Phe
Ser Leu Leu Phe
Thr Cys Lys Lys
Thr Phe Ile Val
Thr Phe Leu Val
Thr Phe Val Ile
Thr Phe Val Leu
Thr Ile Phe Val
Thr Ile Val Phe
Thr Lys Cys Lys
Thr Lys Lys Cys
Thr Leu Phe Val
Thr Leu Val Phe
Thr Val Phe Ile
Thr Val Phe Leu
Thr Val Ile Phe
Thr Val Leu Phe
Val Phe Ile Thr
Val Phe Leu Thr
Val Phe Thr Ile
Val Phe Thr Leu
Val Ile Phe Thr
Val Ile Thr Phe
Val Leu Phe Thr
Val Leu Thr Phe
Val Thr Phe Ile
Val Thr Phe Leu
Val Thr Ile Phe
Val Thr Leu Phe
Val Val Val Tyr
Val Val Tyr Val
Val Tyr Val Val
Tyr Ala Ile Ile
Tyr Ala Ile Leu
Tyr Ala Leu Ile
Tyr Ala Leu Leu
Tyr Ile Ala Ile
Tyr Ile Ala Leu
Tyr Ile Ile Ala
Tyr Ile Leu Ala
Tyr Leu Ala Ile
Tyr Leu Ala Leu
Tyr Leu Ile Ala
Tyr Leu Leu Ala
Tyr Val Val Val
8-(4-{[(3S)-5-Methoxy-3,4-dihydro-2H-chromen-3-yl](propyl)amino}b utyl)-8-azaspiro[4.5]decane-7,9-dione hydrochloride (1:1)
2-BROMO-17-(1,5-DIMETHYLHEXYL)-5,10,13-TRIMETHYLPERHYDROCYCLOPENTA[A]PHENANTHREN-3-ONE
N-[5-(2-methoxy-2-phenylacetyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-(4-methylpiperazin-1-yl)benzamide
Diflucortolone pivalate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
mosapramine
C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics
(1R,2S,4R,5R,8R,9S,11S)-9-formyl-5-methyl-13-propan-2-yl-2-[[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]tetracyclo[7.4.0.02,11.04,8]tridec-12-ene-1-carboxylic acid
2-[5-(2-fluorophenyl)-2-tetrazolyl]-N-[2-(3-methylbutylamino)-2-oxoethyl]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
3-(4-morpholinyl)-N-[11-[2-(4-morpholinyl)-1-oxoethyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]propanamide
4-O-Demethylsordarin
A tetracyclic diterpenoid consisting of sordaricin in which the primary hydroxy hydrogen has been replaced by a 6-deoxy-beta-D-altropyranosyl group.
N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-methyl-3-indolyl)acetamide
(5R,6S,9R)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
(5R,6R,9R)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
(5R,6R,9S)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-methyl-3-indolyl)acetamide
N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4S,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
1-[(5S,6S,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5S,6S,9R)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5S,6R,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-(3-pyridinylmethyl)-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]yl]-2-methoxyethanone
2-(dimethylamino)-1-[(1R)-1-(hydroxymethyl)-7-methoxy-1-(5-pyrimidinylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]ethanone
N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-methyl-3-indolyl)acetamide
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-methyl-3-indolyl)acetamide
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-methyl-3-indolyl)acetamide
N-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
N-[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-5-yl]methyl]-N-methylcyclohexanecarboxamide
(5S,6S,9R)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
(5S,6R,9S)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
(5S,6S,9S)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
(5S,6R,9R)-5-methoxy-14-[(2-methoxy-1-oxoethyl)amino]-3,6,9-trimethyl-2-oxo-N-propan-2-yl-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide
1-[(5S,6R,9R)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5R,6R,9R)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5R,6R,9S)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(5R,6S,9R)-5-methoxy-8-(2-methoxy-1-oxoethyl)-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-propan-2-ylurea
1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-(3-pyridinylmethyl)-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]yl]-2-methoxyethanone
2-(dimethylamino)-1-[(1S)-1-(hydroxymethyl)-7-methoxy-1-(5-pyrimidinylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]ethanone
(1R)-1-(hydroxymethyl)-7-methoxy-2-[(3-methoxyphenyl)methyl]-N-propyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide
[1-Hexanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] octanoate
[2-Heptanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] heptanoate
[1-Pentanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] nonanoate
[1-Acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] dodecanoate
[1-Propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] undecanoate
[1-Butanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] decanoate
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (Z)-hexadec-9-enoate
(1-heptanoyloxy-3-phosphonooxypropan-2-yl) (Z)-tridec-9-enoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (Z)-tetradec-9-enoate
(1-phosphonooxy-3-propanoyloxypropan-2-yl) (Z)-heptadec-9-enoate
(1-acetyloxy-3-phosphonooxypropan-2-yl) (Z)-octadec-9-enoate
(1-pentanoyloxy-3-phosphonooxypropan-2-yl) (Z)-pentadec-9-enoate
5-[(E)-2-(7-hydroxy-4-methoxy-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-yl)ethenyl]-2-(3-methylbut-2-enyl)benzene-1,3-diol
Didecanoylphosphatidate(2-)
A phosphatidate(2-) obtained by deprotonation of both phosphate OH groups of didecanoylphosphatidic acid; major species at pH 7.3.
1,2-Dicapryl-sn-glycero-3-phosphate(2-)
A 1,2-diacyl-sn-glycerol 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1,2-dicapryl-sn-glycero-3-phosphate; major species at pH 7.3.
BisMePA(18:1)
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(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (1s,2s,3s,4r,8s,9s,12r)-2-formyl-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-4-carboxylate
methyl (2s,3s,4as,12bs,14as,14br)-3,10-dihydroxy-2,4a,6,9,12b,14a-hexamethyl-11-oxo-3,4,5,13,14,14b-hexahydro-1h-picene-2-carboxylate
11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,17,20,26-hexaen-28-one
methyl 10-hydroxy-5,9-dimethyl-14-methylidene-6-[(3-phenylprop-2-enoyl)oxy]tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylate
(1s,3s,4s,10s,11r)-4-[(4as,5r,9ar)-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h-naphtho[2,3-b]furan-9a-yl]-7,10,11-trimethyl-2,5-dioxatetracyclo[8.4.0.0¹,³.0⁴,⁸]tetradec-7-en-6-one
(4s,6s)-2-methyl-6-[(1r,2s,5r,6s)-2,5,6-tris(acetyloxy)-4-methylcyclohex-3-en-1-yl]hept-2-en-4-yl (2z)-2-methylbut-2-enoate
1-[4-(acetyloxy)-5-[(acetyloxy)methyl]-1,2,5-trimethyl-6-oxo-3,4,7,8-tetrahydro-2h-naphthalen-1-yl]-3-hydroxy-3-methylpent-4-en-1-yl acetate
4-{3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h-naphtho[2,3-b]furan-9a-yl}-7,10,11-trimethyl-2,5-dioxatetracyclo[8.4.0.0¹,³.0⁴,⁸]tetradec-7-en-6-one
(3r,4as,5s,6s,6as,10s,10as,10br)-6,10-bis(acetyloxy)-3-ethenyl-3,4a,7,7,10a-pentamethyl-1-oxo-octahydronaphtho[2,1-b]pyran-5-yl acetate
6-[7-hydroxy-6-(2-methylbut-3-en-2-yl)-3,4-dihydro-2h-1-benzopyran-2-yl]-2,2-dimethyl-5-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-3,8-diol
(1s,2r,5r,10r,11r,12s,16s,17r,20s,21s,22r)-8-isopropyl-12-methoxy-2,5-dimethyl-15,19,23-trioxahexacyclo[18.2.1.0²,¹⁰.0⁵,⁹.0¹³,²².0¹⁶,²¹]tricosa-8,13-diene-11,16,17,21-tetrol
(3e,5r,7r,8r,10r,11r,12s,15r,16r,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one
2-(acetyloxy)-18-hydroxy-5,5,9-trimethyl-14-oxo-15,17-dioxapentacyclo[11.5.1.0¹,¹⁰.0⁴,⁹.0¹⁶,¹⁹]nonadecan-3-yl butanoate
7-ethenyl-1,4a,7-trimethyl-1-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4,4b,5,6,10,10a-hexahydro-3h-phenanthrene-2,9-dione
[(1as,1bs,3r,3ar,5s,7br,9r,9ar)-3,9-bis(acetyloxy)-5-[(1r)-1,2-dihydroxyethyl]-5,7b-dimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthren-1a-yl]methyl acetate
(5s,7r,8r,10r,11r,12s,15s,16s,17e,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,17,20,26-hexaen-28-one
(1s,4as,7s,10ar)-7-ethenyl-1,4a,7-trimethyl-1-({[(2r,3s,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4,5,6,8,10,10a-hexahydro-3h-phenanthrene-2,9-dione
2,13-bis(acetyloxy)-4,9,12-trimethyl-15-(2-methyloxiran-2-yl)-5-oxatricyclo[10.3.0.0⁴,⁶]pentadec-9-en-11-yl acetate
(1r,2s,3s,4r,7s,8s,9s,12z,14s,17s)-7-(acetyloxy)-2,4-dihydroxy-4,8,12,17-tetramethyl-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadeca-5,12-dien-9-yl butanoate
(1s,4ar,4br,7r,10ar)-7-ethenyl-1,4a,7-trimethyl-1-({[(2r,3s,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4,4b,5,6,10,10a-hexahydro-3h-phenanthrene-2,9-dione
3-[3-(3,7-dimethylocta-2,6-dien-1-yl)-4-hydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-1-(2,4,6-trihydroxyphenyl)propan-1-one
2-deacetyldecinnamoyltaxinine e
{"Ingredient_id": "HBIN005506","Ingredient_name": "2-deacetyldecinnamoyltaxinine e","Alias": "NA","Ingredient_formula": "C26H38O8","Ingredient_Smile": "CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1OC(=O)C)O)O)C)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4736","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-methyl-1-{2-[(1r*,2s*,5r*,6r*)-2,5,6-tri(acetyloxy)-4-methyl-3-cyclohexenyl]-pro-pyl}-2-butenyl(z)-2-methyl-2-butenoate
{"Ingredient_id": "HBIN008861","Ingredient_name": "3-methyl-1-{2-[(1r*,2s*,5r*,6r*)-2,5,6-tri(acetyloxy)-4-methyl-3-cyclohexenyl]-pro-pyl}-2-butenyl(z)-2-methyl-2-butenoate","Alias": "NA","Ingredient_formula": "C26H38O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14759","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
adenanthin b
{"Ingredient_id": "HBIN014673","Ingredient_name": "adenanthin b","Alias": "NA","Ingredient_formula": "C26H38O8","Ingredient_Smile": "CC(=O)OC1CC2CC3(C1C4(C(CC3OC(=O)C)C(C(CC4OC(=O)C)O)(C)C)C)C(C2=C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "606","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}