Exact Mass: 634.243
Exact Mass Matches: 634.243
Found 204 metabolites which its exact mass value is equals to given mass value 634.243
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Rescinnamine
Rescinnamine is only found in individuals that have used or taken this drug. It is an angiotensin-converting enzyme inhibitor used as an antihypertensive drug. It is an alkaloid obtained from Rauwolfia serpentina and other species of Rauwolfia. [Wikipedia]Rescinnamine Binds to and inhibits the angiotensin converting enzyme. Rescinnamine competes with angiotensin I for binding at the angiotensin-converting enzyme, blocking the conversion of angiotensin I to angiotensin II. Inhibition of ACE results in decreased plasma angiotensin II. As angiotensin II is a vasoconstrictor and a negative-feedback mediator for renin activity, lower concentrations result in a decrease in blood pressure and stimulation of baroreceptor reflex mechanisms, which leads to decreased vasopressor activity and to decreased aldosterone secretion. C - Cardiovascular system > C02 - Antihypertensives > C02A - Antiadrenergic agents, centrally acting > C02AA - Rauwolfia alkaloids C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent Rescinnamine is an odorless white to cream colored crystalline powder. (NTP, 1992) Rescinnamine is a methyl ester, an organic heteropentacyclic compound and an indole alkaloid. It has a role as an antihypertensive agent. It derives from a hydride of a yohimban. Rescinnamine is a natural product found in Vinca major, Aspidosperma excelsum, and other organisms with data available.
Ansamitocin P3
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D050258 - Mitosis Modulators > D050256 - Antimitotic Agents > D050257 - Tubulin Modulators D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents Ansamitocin P-3 (Antibiotic C 15003P3) is a microtubule inhibitor. Ansamitocin P-3 is a macrocyclic antitumor antibiotic.
Novobiocin sodium
Novobiocin (Albamycin) sodium is a potent and orally active antibiotic. Novobiocin sodium also is a DNA gyrase inhibitor and a heat shock protein 90 (Hsp90) antagonist. Novobiocin sodium has the potential for the research of highly beta-lactam-resistant pneumococcal infections. Novobiocin sodium shows anti-orthopoxvirus activity. An antibiotic compound derived from Streptomyces niveus. It has a chemical structure similar to coumarin. Novobiocin binds to DNA gyrase, and blocks adenosine triphosphatase (ATPase) activity. (From Reynolds, Martindale The Extra Pharmacopoeia, 30th ed, p189) Novobiocin sodium. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=1476-53-5 (retrieved 2024-10-09) (CAS RN: 1476-53-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Myricanene B 5-[arabinosyl-(1->6)-glucoside]
Myricanene B 5-[arabinosyl-(1->6)-glucoside] is found in fruits. Myricanene B 5-[arabinosyl-(1->6)-glucoside] is a constituent of the stem bark of Myrica rubra (Chinese bayberry). Constituent of the stem bark of Myrica rubra (Chinese bayberry). Myricanene B 5-[arabinosyl-(1->6)-glucoside] is found in fruits.
Myricanene A 5-[arabinosyl-(1->6)-glucoside]
Myricanene A 5-[arabinosyl-(1->6)-glucoside] is found in fruits. Myricanene A 5-[arabinosyl-(1->6)-glucoside] is a constituent of the bark of Myrica rubra (Chinese bayberry). Constituent of the bark of Myrica rubra (Chinese bayberry). Myricanene A 5-[arabinosyl-(1->6)-glucoside] is found in fruits.
Lactodifucotetraose
Lactodifucotetraose (LDFT) is a fucosyloligosaccharide present in human milk and colostrum. Human colostrum is known to be important for the protection of infants against infection by pathogenic microorganisms. This protection is thought to be due, partially, to various neutral and acidic oligosaccharides that are present in colostrum and milk. Lactodifucotetraose decreased substantially until day 5 in human milk and appeared to stabilize in the following days. (PMID: 15343178, 17375110, 2246719). Lactodifucotetraose is a normal blood-group-active oligosaccharide excreted as a component of the urine in type O (H) secretors. (PMID 510288). Lactodifucotetraose (LDFT) is a fucosyloligosaccharide present in human milk and colostrum. Human colostrum is known to be important for the protection of infants against infection by pathogenic microorganisms. This protection is thought to be due, partially, to various neutral and acidic oligosaccharides that are present in colostrum and milk. Lactodifucotetraose decreased substantially until day 5 in human milk and appeared to stabilize in the following days. (PMID: 15343178, 17375110, 2246719)
Ansamitocin P-3
Obacunone 17-O-beta-D-glucoside
Obacunone 17-o-beta-d-glucoside is a member of the class of compounds known as limonoids. Limonoids are highly oxygenated, modified terpenoids with a prototypical structure either containing or derived from a precursor with a 4,4,8-trimethyl-17-furanylsteroid skeleton. All naturally occurring citrus limonoids contain a furan ring attached to the D-ring, at C-17, as well as oxygen containing functional groups at C-3, C-4, C-7, C-16 and C-17. Obacunone 17-o-beta-d-glucoside is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Obacunone 17-o-beta-d-glucoside can be found in lemon, mandarin orange (clementine, tangerine), and sweet orange, which makes obacunone 17-o-beta-d-glucoside a potential biomarker for the consumption of these food products.
Triptofordin D 1
3-Hydroxyethylchlorophyllide a; 3-Devinyl-3-(1-hydroxyethyl)chlorophyllide a
1alpha,2alpha,13-triacetoxy-8beta--isobutanoyloxy-9alpha-benzoyloxy-4beta,6beta-dihydroxy-beta-dihydroagarofuran|1beta,2beta,15-triacetoxy-4alpha,6alpha-dihydroxy-8alpha-isobutanoyloxy-9beta-benzoyloxy-beta-dihydroagrofuran|1beta,2beta,6alpha-triacetoxy-4alpha,6alpha-dihydroxy-8alpha-isobutyryloxy-9beta-benzoyloxydihydro-beta-agarofuran
4-hydroxy-phenylpropenyl-alpha-L-rhamnopyranosyl-(1->3)-4-O-feruloyl-beta-D-glucopyranoside
1??,2??,9??-Triacetoxy-8??-(2-hydroxy-isobutyryoxy)-15-benzoyloxy-4??-hydroxy-??-dihydoagarofuran
2-acetyl-7,6-epoxy-5,6,12-trimethoxy-2-methyl-(1alphaH)-rodiasan-12-ol|N-Acetyl-tiliamosin|N-acetyl-tiliamosine
(23epsilon)-1-O-cinnamoyl-17-defurano-17-(4-hydroxy-2-buten-4-olide-2-yl)salannic acid methyl ester|23-hydroxyohchininolide
(21epsilon)-1-O-cinnamoyl-17-defurano-17-(4-hydroxy-2-buten-4-olide-3-yl)salannic acid methyl ester|21-hydroxyisoohchininolide
3-O-deacetylorthoarisin A|7alpha-acetoxy-2alpha,11alpha-dibenzoyloxy-1alpha,3alpha,8beta-trihydroxyisopimar-15-en-14-one|orthoarisin B
O3-alpha-L-Fucopyranosyl-O4-(O2-alpha-L-fucopyranosyl-beta-D-galactopyranosyl)-D-glucose
2-[3,5-di-O-beta-D-glu-4-(3-methylbut-2-enyl)phenyl]benzofuran-6-ol|2-[3,5-di-O-beta-D-glucosyl-4-(3-methylbut-2-enyl)phenyl]benzofuran-6-ol
3-O-[(Z)-2-methyl-2-butenoyl]-5,20-O-diacetyl-17-O-benzoyl-17-hydroxyingenol
Rescinnamine
Rescinnamine is an odorless white to cream colored crystalline powder. (NTP, 1992) Rescinnamine is a methyl ester, an organic heteropentacyclic compound and an indole alkaloid. It has a role as an antihypertensive agent. It derives from a hydride of a yohimban. Rescinnamine is a natural product found in Vinca major, Aspidosperma excelsum, and other organisms with data available. C - Cardiovascular system > C02 - Antihypertensives > C02A - Antiadrenergic agents, centrally acting > C02AA - Rauwolfia alkaloids C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent
Asp Glu Trp Trp
Asp Trp Glu Trp
Asp Trp Trp Glu
Glu Asp Trp Trp
Glu Trp Asp Trp
Glu Trp Trp Asp
Phe Pro Trp Trp
Phe Trp Pro Trp
Phe Trp Trp Pro
Pro Phe Trp Trp
Pro Trp Phe Trp
Pro Trp Trp Phe
Trp Asp Glu Trp
Trp Asp Trp Glu
Trp Glu Asp Trp
Trp Glu Trp Asp
Trp Phe Pro Trp
Trp Phe Trp Pro
Trp Pro Phe Trp
Trp Pro Trp Phe
Trp Trp Asp Glu
Trp Trp Glu Asp
Trp Trp Phe Pro
Trp Trp Pro Phe
Lactodifucotetraose
Myricanene B 5-[arabinosyl-(1->6)-glucoside]
Myricanene A 5-[arabinosyl-(1->6)-glucoside]
Ansamitocin P-3
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D050258 - Mitosis Modulators > D050256 - Antimitotic Agents > D050257 - Tubulin Modulators D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents Ansamitocin P-3 (Antibiotic C 15003P3) is a microtubule inhibitor. Ansamitocin P-3 is a macrocyclic antitumor antibiotic.
TRIPHENYLOLMETHANE TRIGLYCIDYL ETHER 2,6-TOLYLENE DIISOCYANATE ADDUCT
(Tyr0,Trp2)-Melanocyte-Stimulating Hormone-Release Inhibiting Factor
Novobiocin sodium
D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic Novobiocin (Albamycin) sodium is a potent and orally active antibiotic. Novobiocin sodium also is a DNA gyrase inhibitor and a heat shock protein 90 (Hsp90) antagonist. Novobiocin sodium has the potential for the research of highly beta-lactam-resistant pneumococcal infections. Novobiocin sodium shows anti-orthopoxvirus activity[1][2][3][4]. Novobiocin (Albamycin) sodium is a potent and orally active antibiotic. Novobiocin sodium also is a DNA gyrase inhibitor and a heat shock protein 90 (Hsp90) antagonist. Novobiocin sodium has the potential for the research of highly beta-lactam-resistant pneumococcal infections. Novobiocin sodium shows anti-orthopoxvirus activity[1][2][3][4].
(2S,3S,4S,5Z)-4-(2-carboxylatoethyl)-5-[2-[[5-[(3-ethenyl-2-hydroxy-4-methyl-5-oxo-1H-pyrrol-2-yl)methyl]-3-ethyl-4-(hydroxymethyl)-1H-pyrrol-2-yl]methyl]-3-methyl-4,5-dioxo-3a,6a-dihydro-1H-cyclopenta[b]pyrrol-6-ylidene]-3-methylpyrrolidine-2-carboxylate
[(16Z,18E)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] 2-methylpropanoate
methyl (E)-4-[(1R,2S,8S,9R,10S,12R,13S,14S,17S,19R,20S,21R,23Z)-9,21-dihydroxy-5-(hydroxymethyl)-23-(1-methoxy-1-oxopropan-2-ylidene)-13,20-dimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.02,6.02,14.08,13.010,12.017,19.020,24]tetracosa-5,16(24)-dien-9-yl]-3-methylbut-2-enoate
1-[(2S,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-2-[[(2-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(1-naphthalenyl)urea
1-[(2R,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(1-naphthalenyl)urea
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(1-naphthalenyl)urea
1-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(1-naphthalenyl)urea
1-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
[1-acetyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
[1-butanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
Pentakis(trimethylsilyl)-methyl-6-phosphomannoside
3-(1-hydroxyethyl)bacteriochlorophyllide a
A chlorophyllide obtained by hydrolysis of the terpenoid ester moiety of 3-(1-hydroxyethyl)bacteriochlorophyll a.
(1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enoxy]-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid methyl ester
Ansamitocin P3
A polyketide antibiotic that is isolated from Actinosynnema pretiosum and also exhibits antitumour activity.
[(1r,2s,8r,9s,10s,12r,13r,14s,17s,19r,20s,21r,23z)-9,21-dihydroxy-23-(1-methoxy-1-oxopropan-2-ylidene)-5,13,20-trimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-5,16(24)-dien-9-yl]methyl (2e)-4-hydroxy-2-methylbut-2-enoate
12-(acetyloxy)-4,7-dihydroxy-6-{2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.0²,⁶.0⁹,¹¹]dodec-3-en-9-yl}-11-(hydroxymethyl)-6-methyl-3,9-dioxatetracyclo[6.6.1.0¹,⁵.0¹¹,¹⁵]pentadecan-14-yl 2-methylbut-2-enoate
[(1r,2s,8r,9s,10s,12r,13s,14s,17s,19r,20s,21r)-9,21-dihydroxy-5-(hydroxymethyl)-23-(1-methoxy-1-oxopropan-2-ylidene)-13,20-dimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-5,16(24)-dien-9-yl]methyl (2e)-2-methylbut-2-enoate
(2r,3s,4s,5r,6s)-2-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(10e)-17-hydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(18),2,4,6(19),10,14,16-heptaen-5-yl]oxy}oxane-3,4,5-triol
(2e)-4-{[(1r,2s,8r,9r,10s,12r,13r,14s,17s,19r,20s,21r,23z)-9,21-dihydroxy-23-(1-methoxy-1-oxopropan-2-ylidene)-5,13,20-trimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-5,16(24)-dien-9-yl]oxy}-3-methyl-4-oxobut-2-enoic acid
(2r,3r,4s,4ar,4br,5s,7s,8as,9s,10ar)-3-(acetyloxy)-4-(benzoyloxy)-7-ethenyl-5,8a,9-trihydroxy-1,1,4a,7-tetramethyl-8-oxo-octahydro-2h-phenanthren-2-yl benzoate
(1s,3r,5s,21s)-11-chloro-21,23-dihydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8-oxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.1¹⁰,¹⁴.0³,⁵]hexacosa-10,12,14(26),16,18,22-hexaen-6-yl 2-methylpropanoate
[(1r,2s,8r,9s,10s,12r,13s,14r,17s,19r,20s,21r,23z)-9,21-dihydroxy-5-(hydroxymethyl)-23-(1-methoxy-1-oxopropan-2-ylidene)-13,20-dimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-5,16(24)-dien-9-yl]methyl (2e)-2-methylbut-2-enoate
1-(5-benzyl-6-hydroxy-3-methylhex-3-en-1-yl)-4,7-dihydroxy-6-[(4-methyloct-2-enoyl)oxy]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
(1s,2r,3s,5s,6s,16e,18e,20r,21s)-11-chloro-23-hydroxy-12,20,21-trimethoxy-2,5,9,16-tetramethyl-8-oxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.1¹⁰,¹⁴.0³,⁵]hexacosa-10(26),11,13,16,18,22-hexaen-6-yl propanoate
7-(acetyloxy)-5-(benzoyloxy)-2-ethenyl-6,10,10a-trihydroxy-2,4b,8,8-tetramethyl-1-oxo-octahydro-3h-phenanthren-4-yl benzoate
1β,2β,9α-triacetoxy-8α-(2-hydroxy-isobutyry-oxy)-15-benzoyloxy-4α-hydroxy-β-dihydo-agarofuran
{"Ingredient_id": "HBIN002352","Ingredient_name": "1\u03b2,2\u03b2,9\u03b1-triacetoxy-8\u03b1-(2-hydroxy-isobutyry-oxy)-15-benzoyloxy-4\u03b1-hydroxy-\u03b2-dihydo-agarofuran","Alias": "1beta,2beta,9alpha-triacetoxy-8alpha-(2-hydroxy-isobutyryoxy)-15-benzoyloxy-4alpha-hydroxy-beta-dihydoagarofuran","Ingredient_formula": "C32H42O13","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21508;32088","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-o-deacetylorthosiphol b
{"Ingredient_id": "HBIN013392","Ingredient_name": "7-o-deacetylorthosiphol b","Alias": "NA","Ingredient_formula": "C36H42O10","Ingredient_Smile": "CC(=O)OC1C(C(C2(C(C1(C)C)CC(C3(C2C(CC(C3=O)(C)C=C)OC(=O)C4=CC=CC=C4)O)O)C)OC(=O)C5=CC=CC=C5)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4758","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}