Exact Mass: 586.3551
Exact Mass Matches: 586.3551
Found 486 metabolites which its exact mass value is equals to given mass value 586.3551
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
all-trans-Hexaprenyl diphosphate
all-trans-Hexaprenyl diphosphate is the final product of the hexaprenyl diphosphate biosynthesis pathway. In this pathway, multiple units of isopentenyl diphosphate (IPP) undergo a series of polymerizations to form various polyisoprenoids. There are two different pathways for the biosynthesis of IPP. Bacteria that possess ubiquinone generally use the methylerythritol phosphate pathway (MEP), while the eukaryotic microorganisms use the mevalonate pathway. However, exceptions exist. For example, some eukaryotic microbes, like the green algae and the malarial parasite Plasmodium falciparum, appear to utilize the MEP pathway, and some bacteria utilize the mevalonate pathway (Eisenreich01, Eisenreich04). In Saccharomyces cerevisiae S288C, the initial addition of two isoprenyl units to form (E, E)-farnesyl diphosphate is catalyzed by geranyltransferase / dimethylallyltransferase, encoded by FPP1. An additional unit is added by farnesyltranstransferase (encoded by BTS1), resulting in the formation of all-trans-geranyl-geranyl diphosphate. The last enzyme in this pathway is hexaprenyl diphosphate synthase (encoded by COQ1), which adds additional isoprenoid units to a maximal length unique to the organism. In the case of Saccharomyces cerevisiae S288C, it is 6 units. Polyprenyl diphosphate synthase enzymes, such as hexaprenyl diphosphate synthase, are responsible for determining the final length of the tail. When yeast COQ1 mutants are complemented with homologs from other organisms, ubiquinone biosynthesis is restored, but the tail length of the quinone depends on the source of the enzyme. All-trans-hexaprenyl diphosphate is the final product of hexaprenyl diphosphate biosynthesis pathway.In this pathway multiple units of isopentenyl diphosphate (IPP) undergo a series of polymerizations to form various polyisoprenoids.
Presqualene diphosphate
Presqualene diphosphate is an intermediate in the biosynthesis of Terpenoid. It is a substrate for Farnesyl-diphosphate farnesyltransferase. [HMDB]. Presqualene diphosphate is found in many foods, some of which are soft-necked garlic, pomes, roman camomile, and white cabbage. Presqualene diphosphate is an intermediate in the biosynthesis of Terpenoid. It is a substrate for Farnesyl-diphosphate farnesyltransferase.
18-Dehydroursolic acid 3-arabinoside
18-Dehydroursolic acid 3-arabinoside is found in herbs and spices. 18-Dehydroursolic acid 3-arabinoside is a constituent of Sanguisorba officinalis (burnet bloodwort). Constituent of Sanguisorba officinalis (burnet bloodwort). 18-Dehydroursolic acid 3-arabinoside is found in tea and herbs and spices.
Ganoderic acid Md
Ganoderic acid Md is found in mushrooms. Ganoderic acid Md is a metabolite of Ganoderma lucidum (reishi).
(3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al
(3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al is found in tea. (3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al is a constituent of Assam tea (Camellia sinensis var. assamica). Constituent of Assam tea (Camellia sinensis variety assamica). (3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al is found in tea.
Inuline
Triethylene glycol bis(3-tert-butyl-4-hydroxy-5-methylphenyl)propionate
Bax inhibitor peptide V5
5-Hydroxycapsanthin
5-hydroxycapsanthin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 5-hydroxycapsanthin can be found in a number of food items such as green bell pepper, red bell pepper, pepper (c. annuum), and orange bell pepper, which makes 5-hydroxycapsanthin a potential biomarker for the consumption of these food products.
3beta-(p-Hydroxy-cis-cinnamoyloxy)urs-12-en-28-oic acid
3beta-xi-L-arabinopyranosyloxy-ursa-12,19-dien-28-oic acid|3beta-xi-L-Arabinopyranosyloxy-ursa-12,19-dien-28-saeure|3beta-[(alpha-L-arabinopyranosyl)oxy]-ursa-12,19(20)-dien-28-oic acid
(4alpha,6alpha,7alpha,17alpha,20S,23R,24E)-2,3,5,6-tetrahydro-7,23,26-trihydroxy-6-phenyl-13,30-cyclo-29-nordammara-2,24-dieno[4,3-c]pyran-21-oic acid gamma-lactone|dichapetalin L
6alpha,7alpha-epoxy-4beta,5beta,9alpha,20-tetrahydroxy-13alpha-(2E,4E)-tetradeca-2,4-dienoyl-1-tiglien-3-one|subtoxin B
3??-[(??-L-Arabinopyranosyl)oxy]-urs-12,19(29)-dien-28-oic acid
Palmitic acid 2-methyl-2-(2-oxo-4-methyl-3-pentenyl)-3-hydroxy-5-methoxy-8-formyl-3,4-dihydro-2H-1-benzopyran-7-ylmethyl ester
ethyl (3beta,7beta)-3-(acetyloxy)-7-hydroxy-11,15,23-trioxolanost-8-en-26-oate|ethyl 3-O-acetylganoderate B
3beta-O-(E)-coumaroyl-D:C-friedooleana-7,9(11)-dien-29-ol
14-hydroxyplagiochiline-A-15-yl 2E,4E,8Z-tetradecatrienoate
8-benzoyl-7,7-dimethyl-1-([E]-3,7-dimethyl-2,6-octadienyl)-3-(3-methyl-2-butenyl)-4-(1-hydroxy-1-methylethyl)-tricyclo[4,3,1,1(3,8)]undeca-2,9,11-trione|otogirinin C
(2R,5R,6R,7S,9R)-3,5,6,7,8,9-hexahydro-2-(2-hydroxypropan-2-yl)-6-methyl-7,9-bis(3-methylbut-2-en-1-yl)-6-(4-methylpent-3-en-1-yl)-5-(phenylcarbonyl)-5,9-methanocycloocta[b]furan-4,10(2H)-dione|uralodin B
3-(acetyloxy)-2-{[(3R)-3-(acetyloxy)icosanoyl]oxy}propyl methyl propanedioate
3alpha-acetoxymultiflora-7,9(11)-diene-29-benzoate
3beta,12alpha-diacetoxy-7,8-dihydro-22,25-oxidoholothurinogenin
2-Me ether,3,23-di-Ac-2,3,23-(2alpha,3beta)-Trihydroxy-12-oleanen-28-oic acid
(4S,5S,6S,8S,9S,10R,13R,14S,16S,17Z)-6,16-diacetoxy-25-hydroxy-3,7-dioxo-29-nordammara-1,17(20)-dien-21-oic acid
methyl 2alpha,3alpha-diacetoxy-19alpha-hydroxyurs-12-en-28-oate|methyl euscaphate diacetate
Lys His Phe Arg
MLS000863563-01!1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
C31H46N4O7_2H-Pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(3H,12H)-tetrone, 3-(7,8-dihydroxy-6-oxooctyl)octahydro-9-(1-methylpropyl)-6-(phenylmethyl)
Anthranoyllycoctonine
Origin: Plant; SubCategory_DNP: Terpenoid alkaloids, Diterpene alkaloid, Aconitum alkaloid Annotation level-1
1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone [IIN-based: Match]
1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone [IIN-based on: CCMSLIB00000848942]
Phe His Lys Arg
Phe His Arg Lys
Phe Lys His Arg
Phe Lys Arg His
Phe Arg His Lys
Phe Arg Lys His
His Phe Lys Arg
His Phe Arg Lys
His Lys Phe Arg
His Lys Arg Phe
His Arg Phe Lys
His Arg Lys Phe
Ile Ile Arg Trp
Ile Ile Trp Arg
Ile Leu Arg Trp
Ile Leu Trp Arg
Ile Arg Ile Trp
Ile Arg Leu Trp
Ile Arg Trp Ile
Ile Arg Trp Leu
Ile Trp Ile Arg
Ile Trp Leu Arg
Ile Trp Arg Ile
Ile Trp Arg Leu
Lys Phe His Arg
Lys Phe Arg His
Lys His Arg Phe
Lys Lys Arg Arg
Lys Gln Arg Arg
Lys Arg Phe His
Lys Arg His Phe
Lys Arg Lys Arg
Lys Arg Gln Arg
Lys Arg Arg Lys
Lys Arg Arg Gln
Leu Ile Arg Trp
Leu Ile Trp Arg
Leu Leu Arg Trp
Leu Leu Trp Arg
Leu Arg Ile Trp
Leu Arg Leu Trp
Leu Arg Trp Ile
Leu Arg Trp Leu
Leu Trp Ile Arg
Leu Trp Leu Arg
Leu Trp Arg Ile
Leu Trp Arg Leu
Gln Lys Arg Arg
Gln Gln Arg Arg
Gln Arg Lys Arg
Gln Arg Gln Arg
Gln Arg Arg Lys
Gln Arg Arg Gln
Arg Phe His Lys
Arg Phe Lys His
Arg His Phe Lys
Arg His Lys Phe
Arg Ile Ile Trp
Arg Ile Leu Trp
Arg Ile Trp Ile
Arg Ile Trp Leu
Arg Lys Phe His
Arg Lys His Phe
Arg Lys Lys Arg
Arg Lys Gln Arg
Arg Lys Arg Lys
Arg Lys Arg Gln
Arg Leu Ile Trp
Arg Leu Leu Trp
Arg Leu Trp Ile
Arg Leu Trp Leu
Arg Gln Lys Arg
Arg Gln Gln Arg
Arg Gln Arg Lys
Arg Gln Arg Gln
Arg Arg Lys Lys
Arg Arg Lys Gln
Arg Arg Gln Lys
Arg Arg Gln Gln
Arg Trp Ile Ile
Arg Trp Ile Leu
Arg Trp Leu Ile
Arg Trp Leu Leu
Trp Ile Ile Arg
Trp Ile Leu Arg
Trp Ile Arg Ile
Trp Ile Arg Leu
Trp Leu Ile Arg
Trp Leu Leu Arg
Trp Leu Arg Ile
Trp Leu Arg Leu
Trp Arg Ile Ile
Trp Arg Ile Leu
Trp Arg Leu Ile
Trp Arg Leu Leu
(3b,16a,21b,22a)-12-Oleanene-3,16,21,23,28-pentol-22-angeloyloxy-23-al
Ganoderic acid Md
18-Dehydroursolic acid 3-arabinoside
Presqualene diphosphate
A triterpenyl phosphate that is presqualene in which the hydroxy hydrogen has been replaced by a diphosphate group.
All-trans-hexaprenyl diphosphate
Antioxidant 245
D013501 - Surface-Active Agents > D011092 - Polyethylene Glycols D001697 - Biomedical and Dental Materials
(5ξ,10β)-10,14-Dihydroxycedr-8-ene-12,15-dioic acid - 9,10,15-trihydroxypentadecanoic acid (1:1)
ethane-1,2-diol,hexanedioic acid,2-hydroxyethyl prop-2-enoate,1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
Bax inhibiting peptide V5 (bip-V5)
Bax inhibitor peptide V5 (BIP-V5) is a Bax-mediated apoptosis inhibitor, used for cancer treatment.
1,11,22-Trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone
6beta,16beta-Diacetoxy-25-hydroxy-3,7-dioxy-29-nordammara-1,17(20)-dien-21-oic acid
A tetracyclic triterpenoid that is 29-nordammara-1,17(20)-diene substituted by acetoxy groups at positions 6 and 16, a carboxy group at position 21, a hydroxy group at position 25 and oxo groups at positions 3 and 7 respectively. It is isolated from the marine-derived fungal strain Aspergillus sydowii PFW1-13 and exhibits antibacterial activity.
Integracin B
A benzoate ester obtained by the formal condensation of the hydroxy group of 5-(8-hydroxyundecyl)benzene-1,3-diol with 4,6-dihydroxy benzoic acid which is also substituted by a 8-hydroxyundecyl group at position 2. It is isolated from Cytonaema sp. and has anti-HIV-1 activity.
[(2Z,6Z,10Z,14Z,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaenyl] phosphono hydrogen phosphate
[(1S,2R,3S)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopropyl]methyl phosphono hydrogen phosphate
6-Benzyl-3-butan-2-yl-9-(7,8-dihydroxy-6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
tert-butyl 4-benzyl-4-[[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]amino]pentan-2-yl]carbamoyloxy]piperidine-1-carboxylate
3beta-[(alpha-L-arabinopyranosyl)oxy]-20beta-hydroxyursan-28-oic acid delta-lactone
A triterpenoid saponin based on a ursane-skeleton isolated from the leaves of Rosa laevigata.
6alpha,7alpha-Epoxy-4beta,5beta,9alpha,20-tetrahydroxy-13alpha-(2E,4E)-tetradeca-2,4-dienoyl-1-tiglien-3-one
A natural product found in Pimelea elongata and Pimelea simplex.
1-(4-fluorophenyl)-3-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
1-(4-fluorophenyl)-3-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
1-(4-fluorophenyl)-3-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
1-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea
1-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea
1-(4-fluorophenyl)-3-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
1-(4-fluorophenyl)-3-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
1-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea
1-(4-fluorophenyl)-3-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
1-(4-fluorophenyl)-3-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea
[(4S,5R,6S,8R,10S,13S,16S,18S)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methyl 2-aminobenzoate
[(1S,2R,3R,4S,5R,6S,8R,9S,10R,13S,16S,17R,18S)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methyl 2-aminobenzoate
[(1S,4S,5R,6S,8R,9S,13S,16R,18S)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methyl 2-aminobenzoate
[2-Hydroxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] heptadecanoate
[(2R)-1,1,2,3,3-pentadeuterio-2-hydroxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropyl] heptadecanoate
[(2R)-1,1,3,3-tetradeuterio-2-hydroxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropyl] heptadecanoate
[1-acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (11Z,14Z)-icosa-11,14-dienoate
[1-pentanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-heptadeca-9,12-dienoate
[1-butanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-octadeca-9,12-dienoate
[1-hexanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-hexadeca-9,12-dienoate
[1-propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (9Z,12Z)-nonadeca-9,12-dienoate
(1-octanoyloxy-3-phosphonooxypropan-2-yl) (11Z,14Z,17Z)-icosa-11,14,17-trienoate
(1-hexanoyloxy-3-phosphonooxypropan-2-yl) (10Z,13Z,16Z)-docosa-10,13,16-trienoate
(1-dodecanoyloxy-3-phosphonooxypropan-2-yl) (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
(1-decanoyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
[(2R)-1-decanoyloxy-3-phosphonooxypropan-2-yl] (6E,9E,12E)-octadeca-6,9,12-trienoate
[(2R)-2-decanoyloxy-3-phosphonooxypropyl] (6E,9E,12E)-octadeca-6,9,12-trienoate
(1-dodecanoyloxy-3-phosphonooxypropan-2-yl) (9E,11E,13E)-hexadeca-9,11,13-trienoate
[(2R)-2-decanoyloxy-3-phosphonooxypropyl] (9E,12E,15E)-octadeca-9,12,15-trienoate
[1-[(E)-dodec-5-enoyl]oxy-3-phosphonooxypropan-2-yl] (4E,7E)-hexadeca-4,7-dienoate
[(2R)-1-decanoyloxy-3-phosphonooxypropan-2-yl] (9E,12E,15E)-octadeca-9,12,15-trienoate
2-[[3-acetyloxy-2-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[hydroxy-[3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoxy]-2-pentanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[[2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-3-hexanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[hydroxy-[3-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoxy]-2-propanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium
2-[[3-butanoyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[[2-heptanoyloxy-3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
1-heptadecanoyl-glycero-3-phospho-(1-myo-inositol)
hexaprenyl diphosphate
A polyprenol diphosphate compound having six prenyl units with undefined stereochemistry about the double bonds.
BisMePA(26:3)
Provides by LipidSearch Vendor. © Copyright 2006-2024 Thermo Fisher Scientific Inc. All rights reserved
5-(3,7-dimethylocta-2,6-dien-1-yl)-4-hydroxy-3-(3-hydroxybenzoyl)-8,8-dimethyl-1,7-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione
6-[3,11-bis(acetyloxy)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-10-oxo-1h,2h,3h,4h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid
methyl (2e,6r)-6-[(1r,3r,6s,8s,11r,12s,13s,15r,16r,18r)-6,13-bis(acetyloxy)-18-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl]-2-methylhept-2-enoate
(3r,4r,5r,6r)-4,5-dihydroxy-6-{[(2r)-2-methyl-5-[(4r)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]pentyl]oxy}oxan-3-yl (2e)-5-[(4r,6r)-6-hydroxy-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]-2-methylpent-2-enoate
8-benzoyl-4-(2-hydroxypropan-2-yl)-9-methyl-1,10-bis(3-methylbut-2-en-1-yl)-9-(4-methylpent-3-en-1-yl)-3-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-ene-7,12-dione
(1r,5r,7r)-4-hydroxy-3-(3-hydroxybenzoyl)-8,8-dimethyl-5-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-1,7-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione
(2r,4as,6as,6br,8ar,10s,12ar,12br)-1,2,6a,6b,9,9,12a-heptamethyl-10-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4,5,6,7,8,8a,10,11,12,12b,13-dodecahydro-2h-picene-4a-carboxylic acid
(4as,6as,6br,8as,10s,12ar,12bs,14bs)-1,2,6a,6b,9,9,12a-heptamethyl-10-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-4,5,6,7,8,8a,10,11,12,12b,13,14b-dodecahydro-3h-picene-4a-carboxylic acid
(1s,5s,7s)-7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxy-3-(3-hydroxybenzoyl)-8,8-dimethyl-1,5-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione
[(1s,2r,3r,4s,5r,6s,8r,9r,10s,13s,16s,17r,18s)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-13-yl]methyl 2-aminobenzoate
3a-formyl-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl 3-(4-hydroxyphenyl)prop-2-enoate
7-(3,7-dimethylocta-2,6-dien-1-yl)-4-hydroxy-3-(3-hydroxybenzoyl)-8,8-dimethyl-1,5-bis(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione
6-{11-hydroxy-7-[(3-methoxy-3-oxopropanoyl)oxy]-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-methyl-3-methylideneheptanoic acid
(1r,11s,12r,13r,14e,19s,21s)-10-[(2r,3e,12bs)-3-ethylidene-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl]-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,9-tetraen-11-ol
(2r,4as,6as,6br,8ar,10s,12ar,12br)-10-{[(2s,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-1,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,7,8,8a,10,11,12,12b,13-dodecahydro-2h-picene-4a-carboxylic acid
6-benzyl-5,8,11,14-tetrahydroxy-12-isopropyl-3,9,15-tris(2-methylpropyl)-1-oxa-4,7,10,13-tetraazacyclopentadeca-4,7,10,13-tetraen-2-one
2,2,6a,6b,9,9,12a-heptamethyl-10-[(3-phenylprop-2-enoyl)oxy]-3,4,5,6,7,8,8a,10,11,12,12b,13,14,14a-tetradecahydropicene-4a-carboxylic acid
(2s,3as,3bs,5s,5as,6s,9ar,9bs,11ar)-5-(acetyloxy)-1-[(6s)-6-(2-hydroxypropan-2-yl)-2-oxooxan-3-ylidene]-3a,3b,6,9a-tetramethyl-4,7-dioxo-decahydro-2h-cyclopenta[a]phenanthren-2-yl acetate
(1r,9r,10r,11s,13s,17r,25s,26s,27r,28e,33s,35r,37e,38r)-28,37-diethylidene-8,14,24,30-tetraazadodecacyclo[25.5.2.2¹¹,¹⁴.1¹,⁸.1¹⁰,¹⁷.0²,⁷.0¹⁰,²⁶.0¹³,¹⁷.0¹⁸,²³.0³⁰,³³.0²⁴,³⁵.0²⁶,³⁸]octatriaconta-2,4,6,18,20,22-hexaene-9,25-diol
1-benzoyl-8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-4-(2-hydroxypropan-2-yl)-11,11-dimethyl-10-(3-methylbut-2-en-1-yl)-3-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-ene-7,12-dione
1,5,11,15,22,26-hexahydroxy-1,6,11,16,22,27-hexaazacyclodotriaconta-5,15,26-triene-2,12,23-trione
8-benzoyl-1-(3,7-dimethylocta-2,6-dien-1-yl)-4-(2-hydroxypropan-2-yl)-7,7-dimethyl-3-(3-methylbut-2-en-1-yl)tricyclo[4.3.1.1³,⁸]undecane-2,9,11-trione
{[(1s,2s,3s)-2-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1e)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl]methoxy(hydroxy)phosphoryl}oxyphosphonic acid
22-o-angeloyl theasapogenol e
{"Ingredient_id": "HBIN003747","Ingredient_name": "22-o-angeloyl theasapogenol e","Alias": "NA","Ingredient_formula": "C35H54O7","Ingredient_Smile": "CC=C(C)C(=O)OC1C(C(CC2C1(C(CC3(C2=CCC4C3(CCC5C4(CCC(C5(C)C=O)O)C)C)C)O)CO)(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1237","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β-[(α-l-arabinopyranosyl)oxy]urs-12,18-dien-28-oicacid
{"Ingredient_id": "HBIN008175","Ingredient_name": "3\u03b2-[(\u03b1-l-arabinopyranosyl)oxy]urs-12,18-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C35H54O7","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)C)C)C2=C1C)C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14355","TCMID_id": "1587","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β-[(α-l-arabinopyranosyl)oxy]-urs-12,19(29)-dien-28-oicacid
{"Ingredient_id": "HBIN008176","Ingredient_name": "3\u03b2-[(\u03b1-l-arabinopyranosyl)oxy]-urs-12,19(29)-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C35H54O7","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)C)C)C2C1=C)C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14357","TCMID_id": "1589","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β-[(α-l-arabinopyranosyl)oxy]-urs-12,19-dien-28-oicacid
{"Ingredient_id": "HBIN008179","Ingredient_name": "3\u03b2-[(\u03b1-l-arabinopyranosyl)oxy]-urs-12,19-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C35H54O7","Ingredient_Smile": "CC1=C(C2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC1)C(=O)O)C)C)(C)C)OC6C(C(C(CO6)O)O)O)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14356","TCMID_id": "1588","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anthranoyllycotonine
{"Ingredient_id": "HBIN016292","Ingredient_name": "anthranoyllycotonine","Alias": "NA","Ingredient_formula": "C32H46N2O8","Ingredient_Smile": "CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30611","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}