Exact Mass: 661.3311154
Exact Mass Matches: 661.3311154
Found 106 metabolites which its exact mass value is equals to given mass value 661.3311154,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Nagarine
Aconifine is a diterpenoid that is aconitine bearing a 10-hydroxy substituent. It is functionally related to an aconitine. It derives from a hydride of an aconitane. Aconifine is a natural product found in Aconitum karakolicum, Aconitum nagarum, and Aconitum soongaricum with data available. Origin: Plant; SubCategory_DNP: Terpenoid alkaloids, Diterpene alkaloid, Aconitum alkaloid
norBNI
C40H43N3O6 (661.3151697999999)
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D009292 - Narcotic Antagonists
Norbinaltorphimine
C40H43N3O6 (661.3151697999999)
(16S)-20-Aethyl-1alpha,6alpha,8,16-tetramethoxy-4-methoxymethyl-14alpha-veratroyloxy-aconitan-3alpha,13-diol|(16S)-20-ethyl-1alpha,6alpha,8,16-tetramethoxy-4-methoxymethyl-14alpha-veratroyloxy-aconitane-3alpha,13-diol|8-O-methylveratroylpseudaconine
Asp Arg Trp Trp
Asp Trp Arg Trp
Asp Trp Trp Arg
Phe Phe Trp Tyr
C38H39N5O6 (661.2900193999999)
Phe Phe Tyr Trp
C38H39N5O6 (661.2900193999999)
Phe Trp Phe Tyr
C38H39N5O6 (661.2900193999999)
Phe Trp Tyr Phe
C38H39N5O6 (661.2900193999999)
Phe Tyr Phe Trp
C38H39N5O6 (661.2900193999999)
Phe Tyr Trp Phe
C38H39N5O6 (661.2900193999999)
Arg Asp Trp Trp
Arg Trp Asp Trp
Arg Trp Trp Asp
Trp Asp Arg Trp
Trp Asp Trp Arg
Trp Phe Phe Tyr
C38H39N5O6 (661.2900193999999)
Trp Phe Tyr Phe
C38H39N5O6 (661.2900193999999)
Trp Arg Asp Trp
Trp Arg Trp Asp
Trp Trp Asp Arg
Trp Trp Arg Asp
Trp Tyr Phe Phe
C38H39N5O6 (661.2900193999999)
Tyr Phe Phe Trp
C38H39N5O6 (661.2900193999999)
Tyr Phe Trp Phe
C38H39N5O6 (661.2900193999999)
Tyr Trp Phe Phe
C38H39N5O6 (661.2900193999999)
3,8-Diamino-6-phenyl-5-[6-[1-[2-[(1,2,3,4-tetrahydro-9-acridinyl)amino]ethyl]-1H-1,2,3-triazol-5-YL]hexyl]-phenanthridinium
3,8-Diamino-6-phenyl-5-[6-[1-[2-[(1,2,3,4-tetrahydro-9-acridinyl)amino]ethyl]-1H-1,2,3-triazol-4-YL]hexyl]-phenanthridinium
[(5R,6E,8E,10E,13S,14R,15R,16Z)-15-hydroxy-5-methoxy-14,16-dimethyl-3-oxo-22-thia-2,24-diazatricyclo[18.6.1.021,25]heptacosa-1(27),6,8,10,16,20,23,25-octaen-13-yl] (2R)-2-(cyclohexene-1-carbonylamino)propanoate
C37H47N3O6S (661.3185401999999)
N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[(1-methyl-4-imidazolyl)sulfonyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide
[2-tert-butyl-4-[(1E,3E,5E)-5-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfoindol-2-ylidene]penta-1,3-dienyl]chromen-7-ylidene]-diethylazanium
N-[(4E,8E,12E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyhexadeca-4,8,12-trien-2-yl]butanamide
C32H55NO13 (661.3673220000001)
N-[(4E,8E,12E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyheptadeca-4,8,12-trien-2-yl]propanamide
C32H55NO13 (661.3673220000001)
N-[(4E,8E,12E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxypentadeca-4,8,12-trien-2-yl]pentanamide
C32H55NO13 (661.3673220000001)
N-[(4E,8E,12E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytetradeca-4,8,12-trien-2-yl]hexanamide
C32H55NO13 (661.3673220000001)
N-[(4E,8E,12E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyoctadeca-4,8,12-trien-2-yl]acetamide
C32H55NO13 (661.3673220000001)
[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6E,9E,12E)-pentadeca-6,9,12-trienoyl]oxypropan-2-yl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
[3-[(3E,6E,9E)-dodeca-3,6,9-trienoyl]oxy-2-[(5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Norbinaltorphimine
C40H43N3O6 (661.3151697999999)
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D009292 - Narcotic Antagonists
(1s,2r,3r,4r,5r,6s,7s,8r,9r,10r,13r,14r,16s,17s,18r)-8-ethoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
8-(acetyloxy)-11-ethyl-2,5,7,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
(2s)-n-[(1s)-1-{[(4s)-4-{[(1s)-4-amino-1-{[(3r)-1-hydroxy-2-oxopiperidin-3-yl]-c-hydroxycarbonimidoyl}butyl]-c-hydroxycarbonimidoyl}-4-(methylamino)butyl](hydroxy)carbamoyl}-2-hydroxyethyl]-5-(n-hydroxyacetamido)-2-(methylamino)pentanimidic acid
10-aconifine
{"Ingredient_id": "HBIN000048","Ingredient_name": "10-aconifine","Alias": "NA","Ingredient_formula": "C34H47NO12","Ingredient_Smile": "CCN1CC2(C(CC(C34C2C(C(C31)C5(C6C4(CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC(=O)C)OC)OC)O)COC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "33035","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,2r,3r,4r,5s,6s,8r,9r,10r,13r,14r,16s,17s,18r)-11-ethyl-5,14-dihydroxy-6,8,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3,4-dimethoxybenzoate
8-ethoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
11-ethyl-5,14-dihydroxy-6,8,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3,4-dimethoxybenzoate
4,7-bis(acetyloxy)-3-(benzoyloxy)-13a-hydroxy-2,9,9,12-tetramethyl-5-methylidene-13-oxo-1h,2h,3h,3ah,4h,6h,7h,8h,12h-cyclopenta[12]annulen-8-yl pyridine-3-carboxylate
C37H43NO10 (661.2886818000001)
(1s,2r,3r,4r,5r,6s,7s,8r,9r,10r,13r,14s,15s,16r,17s,18r)-8-(acetyloxy)-11-ethyl-5,7,14,15-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
2-[2-(6-{[(4ar,8s,11r,14s)-9,12-dihydroxy-14-methyl-11-(2-methylpropyl)-5,15-dioxo-3h,4h,4ah,7h,8h,11h,14h-pyridazino[3,2-c]1-oxa-4,7,10-triazacyclotridecan-8-yl]-c-hydroxycarbonimidoyl}-5,6-dihydro-4h-pyridazin-1-yl)-2-oxoethyl]heptanoic acid
(2s,3s,3ar,4r,7r,8s,12s,13ar)-4,7-bis(acetyloxy)-3-(benzoyloxy)-13a-hydroxy-2,9,9,12-tetramethyl-5-methylidene-13-oxo-1h,2h,3h,3ah,4h,6h,7h,8h,12h-cyclopenta[12]annulen-8-yl pyridine-3-carboxylate
C37H43NO10 (661.2886818000001)