Exact Mass: 568.234
Exact Mass Matches: 568.234
Found 14 metabolites which its exact mass value is equals to given mass value 568.234,
within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error
0.0002 dalton.
5??,17??-Dihydroxy-6??,7??-epoxy-1-oxo-3??-O-sulfate-witha-24-enolide
5??,17??-Dihydroxy-6??,7??-epoxy-1-oxo-3??-O-sulfate-witha-24-enolide
2,3-dihydro-3beta-O-sulfate withaferin A|2,3-dihydrowithaferin A 3beta-O-sulfate|2,3-dihydrowithaferin A-3b-O-sulfate|2,3-dihydrowithaferin A-3beta-O-sulfate
2,3-dihydro-3beta-O-sulfate withaferin A|2,3-dihydrowithaferin A 3beta-O-sulfate|2,3-dihydrowithaferin A-3b-O-sulfate|2,3-dihydrowithaferin A-3beta-O-sulfate
2,3-dihydro-3beta-O-sulfate withaferin A
2,3-dihydro-3beta-O-sulfate withaferin A
A withanolide that is 2,3-dihydrowithaferin A substituted by a sulfoxy group at position 3. Isolated from Physalis longifolia, it exhibits antineoplastic activity.
(6-hydroxy-15-{1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl)oxidanesulfonic acid
(6-hydroxy-15-{1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl)oxidanesulfonic acid
5α,17α-dihydroxy-6α,7α-epoxy-1-oxo-3β-o-sulfate-witha-24-enolide
NA
{"Ingredient_id": "HBIN011373","Ingredient_name": "5\u03b1,17\u03b1-dihydroxy-6\u03b1,7\u03b1-epoxy-1-oxo-3\u03b2-o-sulfate-witha-24-enolide","Alias": "NA","Ingredient_formula": "C28H40O10S","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2(CCC3C2(CCC4C3C5C(O5)C6(C4(C(=O)CC(C6)OS(=O)(=O)O)C)O)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5878","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
{15-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl}oxidanesulfonic acid
{15-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl}oxidanesulfonic acid
[(1s,2s,4s,5r,7r,10r,11s,14s,15s,18s)-15-[(1r)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl]oxidanesulfonic acid
[(1s,2s,4s,5r,7r,10r,11s,14s,15s,18s)-15-[(1r)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl]oxidanesulfonic acid
[(2r,6s,7r,9r,16s)-6-hydroxy-15-[(1r)-1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl]oxidanesulfonic acid
[(2r,6s,7r,9r,16s)-6-hydroxy-15-[(1r)-1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl]oxidanesulfonic acid
[(1s,2s,4s,5r,7r,10s,11r,14s,15s,18r)-15-[(1r)-1-[(2s)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl]oxidanesulfonic acid
[(1s,2s,4s,5r,7r,10s,11r,14s,15s,18r)-15-[(1r)-1-[(2s)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-9-oxo-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadecan-7-yl]oxidanesulfonic acid
(2e,4e,6r)-n-{3-chloro-2,5-dihydroxy-4-[(1e,3e,5e)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl]phenyl}-2,4,6-trimethyldeca-2,4-dienimidic acid
(2e,4e,6r)-n-{3-chloro-2,5-dihydroxy-4-[(1e,3e,5e)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl]phenyl}-2,4,6-trimethyldeca-2,4-dienimidic acid
n-(3-chloro-2,5-dihydroxy-4-{6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl}phenyl)-2,4,6-trimethyldeca-2,4-dienimidic acid
n-(3-chloro-2,5-dihydroxy-4-{6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl}phenyl)-2,4,6-trimethyldeca-2,4-dienimidic acid
[(1s,2r,5s,6s,7r,9r,11s,12s,15r,16s)-6-hydroxy-15-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl]oxidanesulfonic acid
[(1s,2r,5s,6s,7r,9r,11s,12s,15r,16s)-6-hydroxy-15-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-3-oxo-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-5-yl]oxidanesulfonic acid
