Exact Mass: 661.3185

Nagarine

C34H47NO12 (661.3098)

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 (661.3152)

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

Lolitrem J

C39H51NO8 (661.3614)

Norbinaltorphimine

C40H43N3O6 (661.3152)

Rubeomycin B

C33H43NO13 (661.2734)

3-methoxyacoforestinine

C36H53O11 (661.3588)

altaconitine

C34H47NO12 (661.3098)

aljesaconitine B

C35H51NO11 (661.3462)

C34H47NO12

C34H47NO12 (661.3098)

(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

C35H51NO11 (661.3462)

C31H47N7O9

C31H47N7O9 (661.3435)

C37H43NO10

C37H43NO10 (661.2887)

Tyr Ser Phe Val Phe

C35H43N5O8 (661.3111)

Thr Arg Glu Glu Lys

C26H47N9O11 (661.3395)

Asp Arg Trp Trp

C32H39N9O7 (661.2972)

Asp Trp Arg Trp

C32H39N9O7 (661.2972)

Asp Trp Trp Arg

C32H39N9O7 (661.2972)

Phe Phe Trp Tyr

C38H39N5O6 (661.29)

Phe Phe Tyr Trp

C38H39N5O6 (661.29)

Phe Trp Phe Tyr

C38H39N5O6 (661.29)

Phe Trp Tyr Phe

C38H39N5O6 (661.29)

Phe Tyr Phe Trp

C38H39N5O6 (661.29)

Phe Tyr Trp Phe

C38H39N5O6 (661.29)

Arg Asp Trp Trp

C32H39N9O7 (661.2972)

Arg Trp Asp Trp

C32H39N9O7 (661.2972)

Arg Trp Trp Asp

C32H39N9O7 (661.2972)

Trp Asp Arg Trp

C32H39N9O7 (661.2972)

Trp Asp Trp Arg

C32H39N9O7 (661.2972)

Trp Phe Phe Tyr

C38H39N5O6 (661.29)

Trp Phe Tyr Phe

C38H39N5O6 (661.29)

Trp Arg Asp Trp

C32H39N9O7 (661.2972)

Trp Arg Trp Asp

C32H39N9O7 (661.2972)

Trp Trp Asp Arg

C32H39N9O7 (661.2972)

Trp Trp Arg Asp

C32H39N9O7 (661.2972)

Trp Tyr Phe Phe

C38H39N5O6 (661.29)

Tyr Phe Phe Trp

C38H39N5O6 (661.29)

Tyr Phe Trp Phe

C38H39N5O6 (661.29)

Tyr Trp Phe Phe

C38H39N5O6 (661.29)

YSFVF

C35H43N5O8 (661.3111)

TREEK

C26H47N9O11 (661.3395)

OKOHA-PS

C31H52NO12P (661.3227)

Suc-Ala-Ala-Pro-Phe-AMC

C34H39N5O9 (661.2748)

Suc-AAPF-AMC is an α-chymotrypsin fluorogenic substrate for the quantitative determination of chymotrypsin activity[1].

2-acetyl-6-hydroxyneomycin C(4+)

C25H51N5O15+4 (661.3381)

2-Acetyl-6-hydroxyparomomycin

C25H49N4O16+3 (661.3143)

[(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 (661.3185)

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

C33H51N5O7S (661.3509)

[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

C38H49N2O6S+ (661.3311)

10-OH-Aconitine

C34H47NO12 (661.3098)

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 (661.3673)

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 (661.3673)

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 (661.3673)

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 (661.3673)

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 (661.3673)

Norbinaltorphimine

C40H43N3O6 (661.3152)

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

CID 4533

C40H43N3O6 (661.3152)

LSM-1313

C40H43N3O6 (661.3152)

PC 16:1/8:3;O3

C32H56NO11P (661.3591)

PC 24:4;O3

C32H56NO11P (661.3591)

PE 16:1/11:3;O3

C32H56NO11P (661.3591)

PE 20:1/7:3;O3

C32H56NO11P (661.3591)

PE 20:2/7:2;O3

C32H56NO11P (661.3591)

PE 22:6/8:3;O

C35H52NO9P (661.338)

PE 27:4;O3

C32H56NO11P (661.3591)

PE 30:9;O

C35H52NO9P (661.338)

LNAPS 26:3;O

C32H56NO11P (661.3591)

PS O-25:5;O3

C31H52NO12P (661.3227)

PS O-26:4;O2

C32H56NO11P (661.3591)

PS P-18:0/8:3;O2

C32H56NO11P (661.3591)

PS P-18:1/7:3;O3

C31H52NO12P (661.3227)

PS P-18:1/8:2;O2

C32H56NO11P (661.3591)

PS 14:0/12:3;O

C32H56NO11P (661.3591)

PS 16:0/9:4;O2

C31H52NO12P (661.3227)

PS 18:0/8:3;O

C32H56NO11P (661.3591)

PS 18:1/7:3;O2

C31H52NO12P (661.3227)

PS 18:2/7:2;O2

C31H52NO12P (661.3227)

PS 18:2/8:1;O

C32H56NO11P (661.3591)

PS 20:1/6:2;O

C32H56NO11P (661.3591)

PS 20:3/5:1;O2

C31H52NO12P (661.3227)

PS 22:2/4:1;O

C32H56NO11P (661.3591)

PS 26:3;O

C32H56NO11P (661.3591)

Hex2Cer 20:3;O2

C32H55NO13 (661.3673)

ST 24:0;O8;HexNAc

C32H55NO13 (661.3673)

ST 25:7;O8;HexNAc

C33H43NO13 (661.2734)

ST 26:6;O7;HexNAc

C34H47NO12 (661.3098)

ST 27:5;O6;HexNAc

C35H51NO11 (661.3462)

(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

C35H51NO11 (661.3462)

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

C34H47NO12 (661.3098)

10-aconifine

C34H47NO12 (661.3098)

{"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

C35H51NO11 (661.3462)

(8s)-10-{[(4s,5s,6s)-4-amino-5-[(1r,3s)-3-hydroxy-1-{[(2s)-1-hydroxypropan-2-yl]oxy}butoxy]-6-methyloxan-2-yl]oxy}-1,6,8,11-tetrahydroxy-8-[(1r)-1-hydroxyethyl]-9,10-dihydro-7h-tetracene-5,12-dione

C33H43NO13 (661.2734)

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

C35H51NO11 (661.3462)

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

C35H51NO11 (661.3462)

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 (661.2887)

(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

C34H47NO12 (661.3098)

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

C31H47N7O9 (661.3435)

(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 (661.2887)

(2r,3r,5r,6s,8r,10r,17s)-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

C35H51NO11 (661.3462)

(3s)-3-{[(2s,3s,4s)-1,3-dihydroxy-4-({hydroxy[(3s)-2-[(2r,3r)-3-hydroxy-2-[(1-hydroxy-2-methoxyethylidene)amino]-4-methylpentanoyl]-1,2-diazinan-3-yl]methylidene}amino)-2-methyl-5-phenylpentylidene]amino}-2-oxopyrrolidine-1-carboximidic acid

C31H47N7O9 (661.3435)

(1s,2r,3r,4r,5r,6s,7s,8r,9r,10r,13r,14s,15r,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

C34H47NO12 (661.3098)

(1r,2s,3s,4r,5r,6s,7s,8s,9r,10r,13r,14r,16s,17r,18r)-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

C34H47NO12 (661.3098)

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

C34H47NO12 (661.3098)

(3r)-3-{[(2s,3s,4s)-1,3-dihydroxy-4-({hydroxy[(3s)-2-[(2r,3r)-3-hydroxy-2-[(1-hydroxy-2-methoxyethylidene)amino]-4-methylpentanoyl]-1,2-diazinan-3-yl]methylidene}amino)-2-methyl-5-phenylpentylidene]amino}-2-oxopyrrolidine-1-carboximidic acid

C31H47N7O9 (661.3435)

10-[(4-amino-5-{3-hydroxy-1-[(1-hydroxypropan-2-yl)oxy]butoxy}-6-methyloxan-2-yl)oxy]-1,6,8,11-tetrahydroxy-8-(1-hydroxyethyl)-9,10-dihydro-7h-tetracene-5,12-dione

C33H43NO13 (661.2734)

(8s)-10-{[(4s,5s,6s)-4-amino-5-[(3s)-3-hydroxy-1-{[(2r)-1-hydroxypropan-2-yl]oxy}butoxy]-6-methyloxan-2-yl]oxy}-1,6,8,11-tetrahydroxy-8-[(1r)-1-hydroxyethyl]-9,10-dihydro-7h-tetracene-5,12-dione

C33H43NO13 (661.2734)

3-[(1,3-dihydroxy-4-{[hydroxy(2-{3-hydroxy-2-[(1-hydroxy-2-methoxyethylidene)amino]-4-methylpentanoyl}-1,2-diazinan-3-yl)methylidene]amino}-2-methyl-5-phenylpentylidene)amino]-2-oxopyrrolidine-1-carboximidic acid

C31H47N7O9 (661.3435)