Exact Mass: 646.2461078
Exact Mass Matches: 646.2461078
Found 36 metabolites which its exact mass value is equals to given mass value 646.2461078,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Calyflorenone B
(2S,4R,6S,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-8-hydroxy-4,6,6a,12,13,13b-hexamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h]bis[1]benzopyran-5-one
6-epi-Calyflorenone B
(2S,4R,6R,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-8-hydroxy-4,6,6a,12,13,13b-hexamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h]bis[1]benzopyran-5-one
butane-1,4-diol,1,3-diisocyanato-2-methylbenzene,2,4-diisocyanato-1-methylbenzene,ethane-1,2-diol,hexanedioic acid
butane-1,4-diol,1,3-diisocyanato-2-methylbenzene,2,4-diisocyanato-1-methylbenzene,ethane-1,2-diol,hexanedioic acid
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-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]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
1-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(1-naphthalenyl)urea
(2S,4S,5R,6R)-5-Acetamido-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-N-methyl-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxamide
(2S,4S,5R,6R)-5-Acetamido-2-[(2R,3S,4S,5R,6S)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-N-methyl-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxamide
4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl 3-phenylprop-2-enoate
4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl 3-phenylprop-2-enoate
4-[(1e,3e)-4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]-c-hydroxycarbonimidoyl}buta-1,3-dien-1-yl]-n-({4-[(1e,3e)-4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]-c-hydroxycarbonimidoyl}buta-1,3-dien-1-yl]phenyl}imino)benzenimine oxide
4-[(1e,3e)-4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]-c-hydroxycarbonimidoyl}buta-1,3-dien-1-yl]-n-({4-[(1e,3e)-4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]-c-hydroxycarbonimidoyl}buta-1,3-dien-1-yl]phenyl}imino)benzenimine oxide
(1s,4as,6s,7r,7as)-6-(acetyloxy)-4-({[(2r,3r,4s,5s,6r)-3-(acetyloxy)-6-[(acetyloxy)methyl]-4,5-dihydroxyoxan-2-yl]oxy}methyl)-7-[(acetyloxy)methyl]-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (2r)-2-methylbutanoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-4-({[(2r,3r,4s,5s,6r)-3-(acetyloxy)-6-[(acetyloxy)methyl]-4,5-dihydroxyoxan-2-yl]oxy}methyl)-7-[(acetyloxy)methyl]-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (2r)-2-methylbutanoate
(2r,5r,7s,10r,11r,15r,17r)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(2r,5r,7s,10r,11r,15r,17r)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
6-(acetyloxy)-4-({[3-(acetyloxy)-6-[(acetyloxy)methyl]-4,5-dihydroxyoxan-2-yl]oxy}methyl)-7-[(acetyloxy)methyl]-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 2-methylbutanoate
6-(acetyloxy)-4-({[3-(acetyloxy)-6-[(acetyloxy)methyl]-4,5-dihydroxyoxan-2-yl]oxy}methyl)-7-[(acetyloxy)methyl]-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 2-methylbutanoate
6''-epi-calyflorenone b
NA
{"Ingredient_id": "HBIN012332","Ingredient_name": "6''-epi-calyflorenone b","Alias": "NA","Ingredient_formula": "C36H38O11","Ingredient_Smile": "COC1CC(OC2=C1C(=O)C(C3(C2(C4=C(C(=C5C(=C4O3)C(CC(O5)C6=CC=CC=C6)O)OC)OC)OC)OC)OC)C7=CC=CC=C7","Ingredient_weight": "646.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6870","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101727395","DrugBank_id": "NA"}
6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 2-methylbutanoate
6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 2-methylbutanoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (2r)-2-methylbutanoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (2r)-2-methylbutanoate
(2s,10s,11s,15r)-2,11,24-trihydroxy-10-[(1e)-3-hydroxy-3-methylbut-1-en-1-yl]-13-methyl-19-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexacyclo[14.8.0.0²,¹¹.0³,⁸.0¹⁰,¹⁵.0¹⁸,²³]tetracosa-1(24),3,5,7,13,16,18,20,22-nonaen-9-one
(2s,10s,11s,15r)-2,11,24-trihydroxy-10-[(1e)-3-hydroxy-3-methylbut-1-en-1-yl]-13-methyl-19-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexacyclo[14.8.0.0²,¹¹.0³,⁸.0¹⁰,¹⁵.0¹⁸,²³]tetracosa-1(24),3,5,7,13,16,18,20,22-nonaen-9-one
4-({4-[(1,4-dihydroxy-2-methylbut-2-en-1-ylidene)amino]butyl}-c-hydroxycarbonimidoyl)-2-(4-hydroxyphenyl)-6,8-dimethoxy-5-oxo-3-phenyl-3,4-dihydro-1-benzoxepine-2-carboxylic acid
4-({4-[(1,4-dihydroxy-2-methylbut-2-en-1-ylidene)amino]butyl}-c-hydroxycarbonimidoyl)-2-(4-hydroxyphenyl)-6,8-dimethoxy-5-oxo-3-phenyl-3,4-dihydro-1-benzoxepine-2-carboxylic acid
(1s,3r,4r,5r,8s,9s,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(1s,3r,4r,5r,8s,9s,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(2r,5s,7r,10r,11r,15r,17s)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(2r,5s,7r,10r,11r,15r,17s)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(5s,7r,10r,11r,15r,17s)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(5s,7r,10r,11r,15r,17s)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(1s,3r,4s,5r,8s,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(1s,3r,4s,5r,8s,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(1s,3r,4s,5r,8s,9r,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(1s,3r,4s,5r,8s,9r,11s,13s,14s)-4-(acetyloxy)-8-formyl-14-(furan-3-yl)-6,6,9,13-tetramethyl-18-methylidene-10,16-dioxo-2,7,15-trioxatetracyclo[9.6.1.0¹,¹³.0³,⁹]octadecan-5-yl (2e)-3-phenylprop-2-enoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5r,6r)-3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(2s,3s,4s)-4-[(4-{[(2e)-1,4-dihydroxy-2-methylbut-2-en-1-ylidene]amino}butyl)-c-hydroxycarbonimidoyl]-2-(4-hydroxyphenyl)-6,8-dimethoxy-5-oxo-3-phenyl-3,4-dihydro-1-benzoxepine-2-carboxylic acid
(2s,3s,4s)-4-[(4-{[(2e)-1,4-dihydroxy-2-methylbut-2-en-1-ylidene]amino}butyl)-c-hydroxycarbonimidoyl]-2-(4-hydroxyphenyl)-6,8-dimethoxy-5-oxo-3-phenyl-3,4-dihydro-1-benzoxepine-2-carboxylic acid
6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[3,4-bis(acetyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
4-(4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]carbamoyl}buta-1,3-dien-1-yl)-n-{[4-(4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]carbamoyl}buta-1,3-dien-1-yl)phenyl]imino}benzenimine oxide
4-(4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]carbamoyl}buta-1,3-dien-1-yl)-n-{[4-(4-{[1-carboxy-3-(c-hydroxycarbonimidoyl)propyl]carbamoyl}buta-1,3-dien-1-yl)phenyl]imino}benzenimine oxide
(2r,5r,7s,10s,11r,15s,17r)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one
(2r,5r,7s,10s,11r,15s,17r)-15-hydroxy-2,7,10,11,20,21-hexamethoxy-5,17-diphenyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁴,¹⁹]henicosa-1(21),3(8),13,19-tetraen-9-one