Exact Mass: 661.2606

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

Streptomycin 6-phosphate

C21H40N7O15P (661.232)

Spectinomycin adenylate

C24H36N7O13P (661.2109)

Streptomycin 3-phosphate

C21H40N7O15P (661.232)

A streptomycin phosphate having the phosphate group placed at the 3-position.

ZINOSTATIN

C35H35NO12 (661.2159)

Paulomenol A

C29H43NO16 (661.2582)

Rubeomycin B

C33H43NO13 (661.2734)

Adiposin 2

C25H43NO19 (661.2429)

altaconitine

C34H47NO12 (661.3098)

C25H43NO19

C25H43NO19 (661.2429)

C34H47NO12

C34H47NO12 (661.3098)

C37H43NO10

C37H43NO10 (661.2887)

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)

Met Trp Tyr Tyr

C34H39N5O7S (661.257)

Met Tyr Trp Tyr

C34H39N5O7S (661.257)

Met Tyr Tyr Trp

C34H39N5O7S (661.257)

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 Met Tyr Tyr

C34H39N5O7S (661.257)

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)

Trp Tyr Met Tyr

C34H39N5O7S (661.257)

Trp Tyr Tyr Met

C34H39N5O7S (661.257)

Tyr Phe Phe Trp

C38H39N5O6 (661.29)

Tyr Phe Trp Phe

C38H39N5O6 (661.29)

Tyr Met Trp Tyr

C34H39N5O7S (661.257)

Tyr Met Tyr Trp

C34H39N5O7S (661.257)

Tyr Trp Phe Phe

C38H39N5O6 (661.29)

Tyr Trp Met Tyr

C34H39N5O7S (661.257)

Tyr Trp Tyr Met

C34H39N5O7S (661.257)

Tyr Tyr Met Trp

C34H39N5O7S (661.257)

Tyr Tyr Trp Met

C34H39N5O7S (661.257)

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].

5-[2,3-Dichloro-4-(5-{1-[2-(2-guanidino-4-methyl-pentanoylamino)-acetyl]-piperidin-4-YL}-1-methyl-1H-pyrazol-3-YL)-phenoxymethyl]-furan-2-carboxylic acid

C30H37Cl2N7O6 (661.2182)

[11-[4,5-Dihydroxy-6-methyl-3-(methylamino)oxan-2-yl]oxy-4-(2-oxo-1,3-dioxolan-4-yl)-5-oxatricyclo[8.3.0.04,6]tridec-1(13)-en-2,7-diyn-12-yl] 2-hydroxy-7-methoxy-5-methylnaphthalene-1-carboxylate

C35H35NO12 (661.2159)

D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors D009676 - Noxae > D003603 - Cytotoxins D000970 - Antineoplastic Agents

2-{4-[2-Acetylamino-2-(1-biphenyl-4-ylmethyl-2-oxo-azepan-3-ylcarbamoyl)-ethyl]-2-methoxycarbonyl-phenyl}-2-fluoro-malonic acid

C35H36FN3O9 (661.2435)

7-[(2R,3R,4S,5R)-3-hydroxy-5-methoxy-6,6-dimethyl-4-(5-methyl-1H-pyrrole-2-carbonyl)oxyoxan-2-yl]oxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-2-oxochromen-4-olate

C35H37N2O11- (661.2397)

(2S)-2-amino-5-[[(1S)-1-carboxy-4-[[(1S)-1-carboxy-4-[2-[4-[[5-(formamidomethyl)furan-3-yl]methoxy]phenyl]ethylamino]-4-oxobutyl]amino]-4-oxobutyl]amino]-5-oxopentanoic acid

C30H39N5O12 (661.2595)

9-O-adenylylspectinomycin

C24H36N7O13P (661.2109)

FM 4-64 dye

C34H53Br2N3 (661.2606)

N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-methoxybenzenesulfonamide

C31H39N3O9S2 (661.2128)

10-OH-Aconitine

C34H47NO12 (661.3098)

3-Adenylylspectinomycin

C24H36N7O13P (661.2109)

ST 25:7;O8;HexNAc

C33H43NO13 (661.2734)

ST 26:6;O7;HexNAc

C34H47NO12 (661.3098)

(5s)-5-[(2s,3s,4s,5s,6s)-6-[(acetyloxy)methyl]-3,5-dihydroxy-4-{[(2r,4s,5s,6s)-5-hydroxy-4-methoxy-6-methyl-5-[(1s)-1-{[(2r)-2-methylbutanoyl]oxy}ethyl]oxan-2-yl]oxy}oxan-2-yl]-2-amino-5-hydroxy-3,6-dioxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

5-{6-[(acetyloxy)methyl]-3,5-dihydroxy-4-[(5-hydroxy-4-methoxy-6-methyl-5-{1-[(2-methylbutanoyl)oxy]ethyl}oxan-2-yl)oxy]oxan-2-yl}-2-amino-4-hydroxy-3,6-dioxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

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"}

(4s,6r,11r,12r)-11-{[(2r,3r,4r,5r,6r)-4,5-dihydroxy-6-methyl-3-(methylamino)oxan-2-yl]oxy}-4-[(4r)-2-oxo-1,3-dioxolan-4-yl]-5-oxatricyclo[8.3.0.0⁴,⁶]tridec-1(13)-en-2,7-diyn-12-yl 2-hydroxy-7-methoxy-5-methylnaphthalene-1-carboxylate

C35H35NO12 (661.2159)

(3s,4s)-3-[(2r,3r,4r,5s,6s)-6-[(acetyloxy)methyl]-3,5-dihydroxy-4-{[(2r,4r,5r,6r)-5-hydroxy-4-methoxy-6-methyl-5-[(1r)-1-{[(2s)-2-methylbutanoyl]oxy}ethyl]oxan-2-yl]oxy}oxan-2-yl]-2,4-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

(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)

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)

(3s)-3-[(2s,3s,4s,5s,6s)-6-[(acetyloxy)methyl]-3,5-dihydroxy-4-{[(2r,4s,5s,6s)-5-hydroxy-4-methoxy-6-methyl-5-[(1s)-1-{[(2r)-2-methylbutanoyl]oxy}ethyl]oxan-2-yl]oxy}oxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

3-{6-[(acetyloxy)methyl]-3,5-dihydroxy-4-[(5-hydroxy-4-methoxy-6-methyl-5-{1-[(2-methylbutanoyl)oxy]ethyl}oxan-2-yl)oxy]oxan-2-yl}-2,3-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

(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)

3-{6-[(acetyloxy)methyl]-3,5-dihydroxy-4-[(5-hydroxy-4-methoxy-6-methyl-5-{1-[(2-methylbutanoyl)oxy]ethyl}oxan-2-yl)oxy]oxan-2-yl}-2,4-dihydroxy-6-imino-5-oxocyclohex-1-ene-1-carboxylic acid

C29H43NO16 (661.2582)

(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)

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)

n-[2-({[(1s,2s,6s,7r,10s,11r,13s,14r,15r)-13-(acetyloxy)-1,6,7-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-14-yl]oxy}carbonyl)phenyl]-2-hydroxybenzenecarboximidic acid

C36H39NO11 (661.2523)