Exact Mass: 630.2598
Exact Mass Matches: 630.2598
Found 231 metabolites which its exact mass value is equals to given mass value 630.2598
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Brassica napus non-fluorescent chlorophyll catabolite 3
Brassica napus non-fluorescent chlorophyll catabolite 3 is found in brassicas. Brassica napus non-fluorescent chlorophyll catabolite 3 is isolated from rape cotyledons. Isolated from rape cotyledons. Brassica napus non-fluorescent chlorophyll catabolite 3 is found in brassicas.
Caspase-1 Inhibitor VI
Nonioside B
Constituent of the fruit of Indian mulberry (Morinda citrifolia), a plant eaten as a famine food and occasionally as a staple in the Pacific region [DFC]. Nonioside B is found in fruits.
Ddabvi
9-Dihydro-13-acetylbaccatin III is a natural product found in Taxus wallichiana with data available. 9-Dihydro-13-acetylbaccatin III (9-DHAB III) is an intermediate for taxol analog preparations. IC50 value: Target: There are a series of closely related natural organic compounds isolated from the Pacific yew tree (Taxus brevifolia) and related species. Taxols have exhibit antitumor agents. 9-Dihydro-13-acetylbaccatin III is an antineoplastic agent and an anti-cancer intermediate. 9-Dihydro-13-acetylbaccatin III (9-DHAB III) is an intermediate for taxol analog preparations. IC50 value: Target: There are a series of closely related natural organic compounds isolated from the Pacific yew tree (Taxus brevifolia) and related species. Taxols have exhibit antitumor agents. 9-Dihydro-13-acetylbaccatin III is an antineoplastic agent and an anti-cancer intermediate.
13-Acetyl-9-dihydrobaccatin III
9-Dihydro-13-acetylbaccatin III (9-DHAB III) is an intermediate for taxol analog preparations. IC50 value: Target: There are a series of closely related natural organic compounds isolated from the Pacific yew tree (Taxus brevifolia) and related species. Taxols have exhibit antitumor agents. 9-Dihydro-13-acetylbaccatin III is an antineoplastic agent and an anti-cancer intermediate. 9-Dihydro-13-acetylbaccatin III (9-DHAB III) is an intermediate for taxol analog preparations. IC50 value: Target: There are a series of closely related natural organic compounds isolated from the Pacific yew tree (Taxus brevifolia) and related species. Taxols have exhibit antitumor agents. 9-Dihydro-13-acetylbaccatin III is an antineoplastic agent and an anti-cancer intermediate.
3,3-(3-ethylidene-16-hydroxy-2,7,13,17-tetramethyl-1,19-dioxo-18-vinyl-1,2,3,15,16,19,22,24-octahydro-21H-biline-8,12-diyl)-bis-propionic acid dimethyl ester|Aplysioviolin
rel-(4-hydroxy-3,5-dimethoxyphenyl){tetrahydro-5-{4-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethoxy]-3,5-dimethoxyphenyl}-4-(hydroxymethyl)furan-3-yl}methanone|seslignanoccidentaliol B
Hybrimycin A1|Hybrimycin A2|Hybrimycin B1|Hybrimycin B2
(2alpha,4alpha,5alpha,7beta,9beta,10beta)-11(15-1)-Abeo-2,20-epoxy-11-taxene-4,5,7,9,10,13,15-heptol
(ent-4beta,6beta,7alpha,8alpha,11E)-4,18-Epoxy-6,7,8,19-tetrahydroxy-11,13-clerodadien-15,16-olide|scutalpin K
2-hydroxyacetic acid rel-(1aR,4R,5R,5aS,7R,9R,9aR,10S,11R,11aS)-9,10-bis(acetyloxy)-5-(benzoyloxy)dodecahydro-4,7-dihydroxy-1a,9a,12,12-tetramethyl-6-methylene-2-oxo-3H-4,11a-methanobenzo[5,6]cyclodec[1,2-b]oxiren-11-yl ester|rel-(2alpha,5alpha,7beta,9alpha,10beta,12alpha)-7,9-bis(acetyloxy)-2-(benzoyloxy)-11,12-epoxy-1,5-dihydroxy-10-[(hydroxyacetyl)oxy]tax-4(20)-en-13-one
[3,3]bi(2-hydroxy-4,5,6-trimethoxydihydrochalcone)
2,6-di(O-beta-D-glucopyranosyl)-1-O-octanoyl-beta-D-glucopyranose|2,6-di-O-(beta-D-glucopyranosyl)-1-O-octanoyl-beta-D-glucopyranose|nonioside B
Me glycoside,2,3,4-tri-Ac-,3,4-dibenzyl-2-O-alpha-L-Rhamnopyranosyl-L-rhamnose
Cys His Trp Trp
Cys Trp His Trp
Cys Trp Trp His
His Cys Trp Trp
His Trp Cys Trp
His Trp Trp Cys
Trp Cys His Trp
Trp Cys Trp His
Trp His Cys Trp
Trp His Trp Cys
Trp Trp Cys His
Trp Trp His Cys
Brassica napus non-fluorescent chlorophyll catabolite 3
2-[[(4S,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carbonyl]amino]-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetic acid
5,5,6,6,7,7,8,8-Octahydro-1,1-binaphthalene-2,2-diylbis(dip henylphosphine)
3-Ethyl-2-[3-(3-ethyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium hexafluorophosphate(1-) (1:1)
12-Ethyl-71-hydroxy-8-propylbacteriochlorophyllide c
3-Deacetyl-3-(1-hydroxyethyl)-bacteriochlorophyllide g
magnesium;3-[(21S,22S)-11-ethyl-16-(1-hydroxyethyl)-3-methoxycarbonyl-12,17,21,26-tetramethyl-4-oxido-23,25-diaza-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),3,5(26),8,10(25),11,13,15,17,19-undecaen-22-yl]propanoate
magnesium;3-[(11R,12R,21S,22S)-16-acetyl-11-ethyl-3-methoxycarbonyl-12,17,21,26-tetramethyl-4-oxido-23,25-diaza-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),3,5(26),8,10(25),13,15,17,19-decaen-22-yl]propanoate
3-[18-(2-Carboxyethyl)-3,7,12,17-tetramethyl-8,13-bis(1-sulfanylethyl)-22,23-dihydroporphyrin-2-yl]propanoic acid
Levesquamide
A polyketide-nonribosomal peptide with an isothiazolinone moiety found in Streptomyces sp. RKND-216. It has a strong selective activity against M. tuberculosis, with no cytotoxicity against mammalian cell lines.
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
3-(1-hydroxyethyl)chlorophyllide a(2-)
A cyclic tetrapyrrole anion that is obtained from 3-(1-hydroxyethyl)chlorophyllide a via deprotonation of the carboxy group and formation of a carbide ion. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
bacteriochlorophyllide a(2-)
A cyclic tetrapyrrole anion that is obtained from bacteriochlorophyllide a via deprotonation of the carboxy group and formation of a carbide ion. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
3-acetylchlorophyllide a
A chlorophyllide obtained by hydrolysis of the terpenoid ester moiety of 3-acetylchlorophyll a.
Z-YVAD-FMK
Z-YVAD-FMK is a?cell-permeable?caspase-1 and -4 inhibitor with?anti-inflammatory and anti-tumor activities[1].
n-{1-[1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl}-2-methylpropanimidic acid
n-{1-[(2r,5s,6r)-5-{[(2r,3r,4s,5s,6r)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]-2-hydroxypyrimidin-4-ylidene}-4-[(4r)-4-(hydroxymethyl)-4-methyl-5-oxoimidazolidin-1-yl]benzamide
(8s,9s,10s,11r)-3-hydroxy-4,5,19-trimethoxy-9,10-dimethyl-11-{[(2e)-3-phenylprop-2-enoyl]oxy}-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2,4,6,13,18-hexaen-8-yl (2e)-2-methylbut-2-enoate
(2r)-n-[(2r)-1-[(1r,9r,10r,11s,12r)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-phenyl-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-triene-10-carbonyl]pyrrolidin-2-yl]-2-methylbutanimidic acid
(1r,2e,4r,15e,19s,20s,23s,24r,25s,28r,30r,32r,33s)-19,32-dihydroxy-23,24-dimethoxy-2-methyl-6,12,17,21,34-pentaoxahexacyclo[28.3.1.0¹,²⁵.0⁴,²⁰.0¹⁰,¹⁴.0²⁸,³³]tetratriaconta-2,10(14),15,26-tetraene-7,11,13,22-tetrone
(1s)-2-[(1r,4r,4ar,5s,6r,8s,8ar)-8-(acetyloxy)-8a-[(acetyloxy)methyl]-5,6-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl 2-methylbut-2-enoate
(3r,5s,10s,13s,14s,15r,23s,26s)-5-chloro-12,14,15,25-tetrahydroxy-23-(hydroxymethyl)-10,23-dimethyl-21-oxa-1,7,8,11,17,18,24,30-octaazatetracyclo[24.4.0.0³,⁸.0¹³,¹⁸]triaconta-11,16,24-triene-2,9,19,22-tetrone
3-{2-[5-acetyl-2-(5,7-dimethyl-2-oxonona-3,5-dien-1-yl)-4,5-dihydroxy-3-oxocyclopent-1-en-1-yl]-4,5-dihydroxyphenyl}-4-hydroxy-5-[(4-hydroxyphenyl)methylidene]furan-2-one
(1s,3r,4s,5s,7r,8s,9r,12s,13s,16s)-16-(acetyloxy)-13-(furan-3-yl)-5-hydroxy-7-(2-methoxy-2-oxoethyl)-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.0¹,¹².0³,⁸]heptadecan-4-yl 3-methylbutanoate
(1s)-2-[(1r,4r,4ar,5s,6r,8s,8ar)-8-(acetyloxy)-8a-[(acetyloxy)methyl]-5,6-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl (2z)-2-methylbut-2-enoate
methyl 2-[(3r,4r,5s)-4-[(1ar,3s,3ar,4r,5r,6r,7as)-4,5-bis(acetyloxy)-3-(furan-3-yl)-3a-methyl-7-methylidene-hexahydroindeno[1,7a-b]oxiren-6-yl]-5-(acetyloxy)-2,2,4-trimethyl-7-oxooxepan-3-yl]acetate
(1s,2r,4s,5s,6r,7s,9r)-5-(acetyloxy)-6-[(acetyloxy)methyl]-2,10,10-trimethyl-4-{[(2e)-3-phenylprop-2-enoyl]oxy}-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl (2e)-3-phenylprop-2-enoate
(2z,15z)-19,32-dihydroxy-23,24-dimethoxy-2-methyl-6,12,17,21,34-pentaoxahexacyclo[28.3.1.0¹,²⁵.0⁴,²⁰.0¹⁰,¹⁴.0²⁸,³³]tetratriaconta-2,10(14),15,26-tetraene-7,11,13,22-tetrone
(3s,4s,4as,5r,6r,6as,7r,11as,11br)-3-(acetyloxy)-5,6-bis(benzoyloxy)-4a-hydroxy-4,7,11b-trimethyl-1h,2h,3h,5h,6h,6ah,7h,11h,11ah-phenanthro[3,2-b]furan-4-carboxylic acid
(1s,9r,13r,21s)-1-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-17-(6-hydroxy-1-benzofuran-2-yl)-11-methyl-2,20-dioxapentacyclo[11.7.1.0³,⁸.0⁹,²¹.0¹⁴,¹⁹]henicosa-3,5,7,11,14,16,18-heptaene-5,15-diol
(1r,2s,4r,5r,9s,10s,13s,14r,15r,17r)-15-[(1r)-1-(acetyloxy)-2-methoxy-2-oxoethyl]-9-(furan-3-yl)-1-hydroxy-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,⁴.0⁴,¹³.0⁵,¹⁰]octadecan-17-yl 2-methylpropanoate
(1r,4r,7s,9s)-4-benzyl-9-(3-{[(2s,5r)-3,6-dihydroxy-5-(2-methylpropyl)-2,5-dihydropyrazin-2-yl]methyl}indol-1-yl)-6-hydroxy-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-5,10,12,14-tetraen-3-one
(1r,2s,3s,5s,8r,9r,10s,11s,13r,16s)-9,11,16-tris(acetyloxy)-5,8-dihydroxy-3-(2-hydroxypropan-2-yl)-6,10-dimethyl-14-oxatetracyclo[8.6.0.0³,⁷.0¹³,¹⁶]hexadec-6-en-2-yl benzoate
2-(4-hydroxyphenyl)ethyl (4s,5e,6s)-5-ethylidene-4-{2-[4-(2-hydroxyethyl)phenoxy]-2-oxoethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
10-(beta-hydroxybutyryl)-10-deacetylbaccatin i
{"Ingredient_id": "HBIN000075","Ingredient_name": "10-(beta-hydroxybutyryl)-10-deacetylbaccatin i","Alias": "10-(\u03b2-hydroxybutyryl)-10-deacetylbaccatin i; 5beta,20-Epoxy-9-oxotax-11-en-1,2alpha,4,7beta,10beta,13alpha-hexol 2-benzoate 4-acetate 10-(3-hydroxybutyrate)","Ingredient_formula": "C33H42O12","Ingredient_Smile": "CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)CC(C)O","Ingredient_weight": "630.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT19245","TCMID_id": "31162;9864","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5318160","DrugBank_id": "NA"}
13-decinnamoyl-9-deacetyltaxchinin b
{"Ingredient_id": "HBIN001162","Ingredient_name": "13-decinnamoyl-9-deacetyltaxchinin b","Alias": "NA","Ingredient_formula": "C33H42O12","Ingredient_Smile": "CC1=C2C(C(C3(C(CC4C(C3C(C2(CC1O)C(C)(C)O)OC(=O)C)(CO4)OC(=O)C)OC(=O)C)C)O)OC(=O)C5=CC=CC=C5","Ingredient_weight": "630.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4850","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101995266","DrugBank_id": "NA"}
15-benzoyl-2-debenzoyl-7,9-dideacetyl-abeo-baccatin vi
{"Ingredient_id": "HBIN001624","Ingredient_name": "15-benzoyl-2-debenzoyl-7,9-dideacetyl-abeo-baccatin vi","Alias": "NA","Ingredient_formula": "C33H42O12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2237","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,9-deacetylbaccatin vi
{"Ingredient_id": "HBIN013002","Ingredient_name": "7,9-deacetylbaccatin vi","Alias": "NA","Ingredient_formula": "C33H42O12","Ingredient_Smile": "CC1=C2C(C(C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4725","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}