Exact Mass: 589.3379512

20,21-Diprenylterpendole I

C37H51NO5 (589.3767036)

Benzoylmesaconine

C31H43NO10 (589.2886818000001)

Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis. Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis.

(2E,4E)-N-[2-[[(2R,3R,4R,5R,6S)-2-(1,2-Dihydroxyethyl)-4,5-dihydroxy-6-(7H-purin-6-ylamino)oxan-3-yl]amino]-2-oxoethyl]tetradeca-2,4-dienamide

C28H43N7O7 (589.3223808)

Mesaconine

C31H43NO10 (589.2886818000001)

Benzoylmesaconine

C31H43NO10 (589.2886818000001)

Aconitane-3,8,13,14,15-pentol, 4-(methoxymethyl)-20-methyl-1,6,16-trimethoxy-, 14-benzoate, (1-alpha,3-alpha,6-alpha,14-alpha,15-alpha,16-beta)- is a natural product found in Aconitum, Aconitum jaluense, and Aconitum carmichaelii with data available. Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis. Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis.

O-12-Methyl-alpha-ergokryptine

C33H43N5O5 (589.3264028)

Peptaibolin

C31H51N5O6 (589.3839146)

Detoxin D5

C31H47N3O8 (589.3362982)

Circinasine B

C31H43NO10 (589.2886818000001)

cruentaren B

C33H51NO8 (589.3614486)

petunianine D 7-acetate

C36H47NO6 (589.3403202)

Ergogaline

C33H43N5O5 (589.3264028)

Ala-Gly-Val-Thr-Ser-Arg

C23H43N9O9 (589.3183588)

Benzoylmesaconine

C31H43NO10 (589.2886818000001)

A diterpene alkaloid with formula C31H43NO10 that is isolated from several Aconitum species. Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis. Benzoylmesaconine is the most abundant component of Wutou decoction, which is widely used in China because of its therapeutic effect on rheumatoid arthritis.

(20R,25R)-23,26-epimino-3beta-hydroxy-5alpha-cholest-23(N)-ene-6,22-dione 3-O-beta-D-glucopyranoside

C33H51NO8 (589.3614486)

petuniasterone C 22-nicotinate-7-acetate

C36H47NO6 (589.3403202)

petisinine

C33H51NO8 (589.3614486)

Angeloylzygadenine

C33H51NO8 (589.3614486)

cruentaren A

C33H51NO8 (589.3614486)

Ergoheptine

C33H43N5O5 (589.3264028)

(32S,6S)-6-benzyl-31-[N-(N,N-dimethyl-L-alanyl)-L-leucyl]-(32rH,33tH)-2-oxa-5,8-diaza-1(1,4)-benzena-3(3,2)-pyrrolidina-cyclodecaphan-9c-ene-4,7-dione|Mauritin H|Mauritine H|mauritine-H

C33H43N5O5 (589.3264028)

Glu Thr Leu Leu Ser

C26H47N5O10 (589.3322762)

C34H43N3O6

C34H43N3O6 (589.3151698)

2-((4R)-N-benzyl-4-((3R,5S,7S,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid

C33H51NO6S (589.3436906000001)

Ala Lys Trp Trp

C31H39N7O5 (589.3012524)

Ala Trp Lys Trp

C31H39N7O5 (589.3012524)

Ala Trp Trp Lys

C31H39N7O5 (589.3012524)

Cys Arg Arg Arg

C21H43N13O5S (589.3230668)

Glu Lys Lys Trp

C28H43N7O7 (589.3223808)

Glu Lys Trp Lys

C28H43N7O7 (589.3223808)

Glu Trp Lys Lys

C28H43N7O7 (589.3223808)

Lys Ala Trp Trp

C31H39N7O5 (589.3012524)

Lys Glu Lys Trp

C28H43N7O7 (589.3223808)

Lys Glu Trp Lys

C28H43N7O7 (589.3223808)

Lys Lys Glu Trp

C28H43N7O7 (589.3223808)

Lys Lys Trp Glu

C28H43N7O7 (589.3223808)

Lys Met Arg Arg

C23H47N11O5S (589.3482172)

Lys Arg Met Arg

C23H47N11O5S (589.3482172)

Lys Arg Arg Met

C23H47N11O5S (589.3482172)

Lys Arg Thr Trp

C27H43N9O6 (589.3336138)

Lys Arg Trp Thr

C27H43N9O6 (589.3336138)

Lys Thr Arg Trp

C27H43N9O6 (589.3336138)

Lys Thr Trp Arg

C27H43N9O6 (589.3336138)

Lys Trp Ala Trp

C31H39N7O5 (589.3012524)

Lys Trp Glu Lys

C28H43N7O7 (589.3223808)

Lys Trp Lys Glu

C28H43N7O7 (589.3223808)

Lys Trp Arg Thr

C27H43N9O6 (589.3336138)

Lys Trp Thr Arg

C27H43N9O6 (589.3336138)

Lys Trp Trp Ala

C31H39N7O5 (589.3012524)

Met Lys Arg Arg

C23H47N11O5S (589.3482172)

Met Gln Arg Arg

C22H43N11O6S (589.3118338)

Met Arg Lys Arg

C23H47N11O5S (589.3482172)

Met Arg Gln Arg

C22H43N11O6S (589.3118338)

Met Arg Arg Lys

C23H47N11O5S (589.3482172)

Met Arg Arg Gln

C22H43N11O6S (589.3118338)

Gln Met Arg Arg

C22H43N11O6S (589.3118338)

Gln Arg Met Arg

C22H43N11O6S (589.3118338)

Gln Arg Arg Met

C22H43N11O6S (589.3118338)

Gln Arg Thr Trp

C26H39N9O7 (589.2972304)

Gln Arg Trp Thr

C26H39N9O7 (589.2972304)

Gln Thr Arg Trp

C26H39N9O7 (589.2972304)

Gln Thr Trp Arg

C26H39N9O7 (589.2972304)

Gln Trp Arg Thr

C26H39N9O7 (589.2972304)

Gln Trp Thr Arg

C26H39N9O7 (589.2972304)

Arg Cys Arg Arg

C21H43N13O5S (589.3230668)

Arg Lys Met Arg

C23H47N11O5S (589.3482172)

Arg Lys Arg Met

C23H47N11O5S (589.3482172)

Arg Lys Thr Trp

C27H43N9O6 (589.3336138)

Arg Lys Trp Thr

C27H43N9O6 (589.3336138)

Arg Met Lys Arg

C23H47N11O5S (589.3482172)

Arg Met Gln Arg

C22H43N11O6S (589.3118338)

Arg Met Arg Lys

C23H47N11O5S (589.3482172)

Arg Met Arg Gln

C22H43N11O6S (589.3118338)

Arg Gln Met Arg

C22H43N11O6S (589.3118338)

Arg Gln Arg Met

C22H43N11O6S (589.3118338)

Arg Gln Thr Trp

C26H39N9O7 (589.2972304)

Arg Gln Trp Thr

C26H39N9O7 (589.2972304)

Arg Arg Cys Arg

C21H43N13O5S (589.3230668)

Arg Arg Lys Met

C23H47N11O5S (589.3482172)

Arg Arg Met Lys

C23H47N11O5S (589.3482172)

Arg Arg Met Gln

C22H43N11O6S (589.3118338)

Arg Arg Gln Met

C22H43N11O6S (589.3118338)

Arg Arg Arg Cys

C21H43N13O5S (589.3230668)

Arg Thr Lys Trp

C27H43N9O6 (589.3336138)

Arg Thr Gln Trp

C26H39N9O7 (589.2972304)

Arg Thr Trp Lys

C27H43N9O6 (589.3336138)

Arg Thr Trp Gln

C26H39N9O7 (589.2972304)

Arg Trp Lys Thr

C27H43N9O6 (589.3336138)

Arg Trp Gln Thr

C26H39N9O7 (589.2972304)

Arg Trp Thr Lys

C27H43N9O6 (589.3336138)

Arg Trp Thr Gln

C26H39N9O7 (589.2972304)

Thr Lys Arg Trp

C27H43N9O6 (589.3336138)

Thr Lys Trp Arg

C27H43N9O6 (589.3336138)

Thr Gln Arg Trp

C26H39N9O7 (589.2972304)

Thr Gln Trp Arg

C26H39N9O7 (589.2972304)

Thr Arg Lys Trp

C27H43N9O6 (589.3336138)

Thr Arg Gln Trp

C26H39N9O7 (589.2972304)

Thr Arg Trp Lys

C27H43N9O6 (589.3336138)

Thr Arg Trp Gln

C26H39N9O7 (589.2972304)

Thr Trp Lys Arg

C27H43N9O6 (589.3336138)

Thr Trp Gln Arg

C26H39N9O7 (589.2972304)

Thr Trp Arg Lys

C27H43N9O6 (589.3336138)

Thr Trp Arg Gln

C26H39N9O7 (589.2972304)

Trp Ala Lys Trp

C31H39N7O5 (589.3012524)

Trp Ala Trp Lys

C31H39N7O5 (589.3012524)

Trp Glu Lys Lys

C28H43N7O7 (589.3223808)

Trp Lys Ala Trp

C31H39N7O5 (589.3012524)

Trp Lys Glu Lys

C28H43N7O7 (589.3223808)

Trp Lys Lys Glu

C28H43N7O7 (589.3223808)

Trp Lys Arg Thr

C27H43N9O6 (589.3336138)

Trp Lys Thr Arg

C27H43N9O6 (589.3336138)

Trp Lys Trp Ala

C31H39N7O5 (589.3012524)

Trp Gln Arg Thr

C26H39N9O7 (589.2972304)

Trp Gln Thr Arg

C26H39N9O7 (589.2972304)

Trp Arg Lys Thr

C27H43N9O6 (589.3336138)

Trp Arg Gln Thr

C26H39N9O7 (589.2972304)

Trp Arg Thr Lys

C27H43N9O6 (589.3336138)

Trp Arg Thr Gln

C26H39N9O7 (589.2972304)

Trp Thr Lys Arg

C27H43N9O6 (589.3336138)

Trp Thr Gln Arg

C26H39N9O7 (589.2972304)

Trp Thr Arg Lys

C27H43N9O6 (589.3336138)

Trp Thr Arg Gln

C26H39N9O7 (589.2972304)

Trp Trp Ala Lys

C31H39N7O5 (589.3012524)

Trp Trp Lys Ala

C31H39N7O5 (589.3012524)

LSLEE

C25H43N5O11 (589.2958928)

METHANAMINE (3R,5R)-7-(2-(4-FLUOROPHENYL)-5-ISOPROPYL-3-PHENYL-4-(PHENYLCARBAMOYL)-1H-PYRROL-1-YL)-3,5-DIHYDROXYHEPTANOATE

C34H40FN3O5 (589.2951842)

Mergocriptine

C33H43N5O5 (589.3264028)

3,6-BIS(2-METHYL-2-MORPHOLINOPROPIONYL)-9-OCTYLCARBAZOLE

C36H51N3O4 (589.3879366)

4-[6-[[6-(1-Butoxyvinyl)-8-cyclopentyl-5-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino]pyridin-3-yl]piperazine-1-carboxylic acid tert-butyl ester

C32H43N7O4 (589.3376357999999)

MMT-HEXYLAMINE-LINKER AMIDITE 0.15G, AB,

C35H48N3O3P (589.3433107999999)

MMT-Hexylaminolinker Phosphoramidite is a cleavable linker. MMT-Hexylaminolinker Phosphoramidite can be used to syntheses oligonucleotide gapmers or other nucleic acid molecules[1][2].

3-hydroxyclarithromycin

C30H55NO10 (589.382577)

6-(4-Deoxy-4-((2E,4E)-tetradecadienoylglycyl)amino-L-glycero-b-L-mannoheptopyranosyl)amino-9H-purine

C28H43N7O7 (589.3223808)

C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C259 - Antineoplastic Antibiotic C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000970 - Antineoplastic Agents

Norbuprenorphine 3-glucuronide

C31H43NO10 (589.2886818000001)

(1S,2R,5S,7S,12S,15S)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-19,20-bis(3-methylbut-2-enyl)-6,10-dioxa-24-azaheptacyclo[13.10.0.02,12.05,11.09,11.017,25.018,23]pentacosa-17(25),18(23),19,21-tetraene-8,12-diol

C37H51NO5 (589.3767036)

Amikacin(4+)

C22H47N5O13+4 (589.3170212)

Apetaline C

C32H39N5O6 (589.2900194)

A natural product found in Ziziphus apetala.

Lasalocid anion

C34H53O8- (589.3740238)

N-[[(3R,9S,10S)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea

C32H39N5O6 (589.2900194)

N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

1-[[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea

C32H39N5O6 (589.2900194)

1-[[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea

C32H39N5O6 (589.2900194)

N-[[(3R,9R,10S)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(3R,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9R,10R)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9R,10S)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9S,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9R,10S)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9R,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9S,10R)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9R,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9S,10S)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9R,10R)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclohexanecarboxamide

C32H42F3N3O4 (589.3127248)

N-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3S,9S,10S)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9S,10S)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9S,10R)-16-(dimethylamino)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

N-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide

C31H47N3O6S (589.3185402)

N-[[(3R,9R,10S)-16-(dimethylamino)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N,4-dimethylbenzenesulfonamide

C31H47N3O6S (589.3185402)

2-((4R)-N-benzyl-4-((3R,5S,7S,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid

C33H51NO6S (589.3436906000001)

Lnaps 16:3/N-6:0

C28H48NO10P (589.3015677999999)

Lnape 22:2/N-3:0

C30H56NO8P (589.3743346)

Lnaps 4:0/N-18:3

C28H48NO10P (589.3015677999999)

Lnape 4:0/N-21:2

C30H56NO8P (589.3743346)

Lnaps 6:0/N-16:3

C28H48NO10P (589.3015677999999)

Lnape 20:2/N-5:0

C30H56NO8P (589.3743346)

Lnape 19:2/N-6:0

C30H56NO8P (589.3743346)

Lnape 18:2/N-7:0

C30H56NO8P (589.3743346)

Lnaps 2:0/N-20:3

C28H48NO10P (589.3015677999999)

Lnape 9:0/N-16:2

C30H56NO8P (589.3743346)

Lnape 3:0/N-22:2

C30H56NO8P (589.3743346)

Lnape 5:0/N-20:2

C30H56NO8P (589.3743346)

Lnaps 18:3/N-4:0

C28H48NO10P (589.3015677999999)

Lnape 16:2/N-9:0

C30H56NO8P (589.3743346)

Lnape 8:0/N-17:2

C30H56NO8P (589.3743346)

Lnaps 20:3/N-2:0

C28H48NO10P (589.3015677999999)

Lnape 6:0/N-19:2

C30H56NO8P (589.3743346)

Lnape 17:2/N-8:0

C30H56NO8P (589.3743346)

Lnape 7:0/N-18:2

C30H56NO8P (589.3743346)

Lnape 21:2/N-4:0

C30H56NO8P (589.3743346)

HexCer 8:0;3O/16:2;(2OH)

C30H55NO10 (589.382577)

HexCer 12:1;3O/12:1;(2OH)

C30H55NO10 (589.382577)

(4E,8E)-2-[[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyl]amino]-3-hydroxydodeca-4,8-diene-1-sulfonic acid

C34H55NO5S (589.380074)

(E)-3-hydroxy-2-[[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoyl]amino]dec-4-ene-1-sulfonic acid

C34H55NO5S (589.380074)

(4E,8E,12E)-3-hydroxy-2-[[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]amino]hexadeca-4,8,12-triene-1-sulfonic acid

C34H55NO5S (589.380074)

(4E,8E)-3-hydroxy-2-[[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]amino]tetradeca-4,8-diene-1-sulfonic acid

C34H55NO5S (589.380074)

(4E,8E,12E)-2-[[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]amino]-3-hydroxyoctadeca-4,8,12-triene-1-sulfonic acid

C34H55NO5S (589.380074)

(4E,8E)-3-hydroxy-2-[[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoyl]amino]hexadeca-4,8-diene-1-sulfonic acid

C34H55NO5S (589.380074)

(E)-2-[[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]amino]-3-hydroxydodec-4-ene-1-sulfonic acid

C34H55NO5S (589.380074)

(4E,8E,12E)-3-hydroxy-2-[[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]amino]tetradeca-4,8,12-triene-1-sulfonic acid

C34H55NO5S (589.380074)

2-amino-3-[[3-butanoyloxy-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C28H48NO10P (589.3015677999999)

2-amino-3-[[2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-3-hexanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C28H48NO10P (589.3015677999999)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-nonanoyloxypropan-2-yl] (9Z,12Z)-hexadeca-9,12-dienoate

C30H56NO8P (589.3743346)

[3-butanoyloxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-propanoyloxypropan-2-yl] (13Z,16Z)-docosa-13,16-dienoate

C30H56NO8P (589.3743346)

[3-acetyloxy-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-heptanoyloxypropan-2-yl] (9Z,12Z)-octadeca-9,12-dienoate

C30H56NO8P (589.3743346)

[2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-pentanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-butanoyloxypropan-2-yl] (11Z,14Z)-henicosa-11,14-dienoate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hexanoyloxypropan-2-yl] (9Z,12Z)-nonadeca-9,12-dienoate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-octanoyloxypropan-2-yl] (9Z,12Z)-heptadeca-9,12-dienoate

C30H56NO8P (589.3743346)

[2-[(9Z,12Z)-hexadeca-9,12-dienoyl]oxy-3-hexanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H56NO8P (589.3743346)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-pentanoyloxypropan-2-yl] (11Z,14Z)-icosa-11,14-dienoate

C30H56NO8P (589.3743346)

[2-[(9Z,12Z)-nonadeca-9,12-dienoyl]oxy-3-propanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H56NO8P (589.3743346)

3-[[3-acetyloxy-2-[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxy-2-aminopropanoic acid

C28H48NO10P (589.3015677999999)

Amikacin(4+)

C22H47N5O13 (589.3170212)

An organic cation obtained by protonation of the four free amino groups of amikacin; major species at pH 7.3.

lasalocid(1-)

C34H53O8 (589.3740238)

A member of the class of benzoates that is the conjugate base of lasalocid, resulting from the deprotonation of the carboxy group. Major species at pH 7.3.

DGCC 20:1;O2

C30H55NO10 (589.382577)

DGCC 23:6

C33H51NO8 (589.3614486)

DGTS 23:6;O

C33H51NO8 (589.3614486)

PC O-22:3;O

C30H56NO8P (589.3743346)

PC P-16:0/6:2;O

C30H56NO8P (589.3743346)

PC P-18:1/4:1;O

C30H56NO8P (589.3743346)

LPC 20:5;O3

C28H48NO10P (589.3015677999999)

PC 14:0/7:3;O

C29H52NO9P (589.3379512)

PC 21:3;O

C29H52NO9P (589.3379512)

PC 18:1/4:1

C30H56NO8P (589.3743346)

PC 18:2/4:0

C30H56NO8P (589.3743346)

PC 20:2/2:0

C30H56NO8P (589.3743346)

PC 22:2

C30H56NO8P (589.3743346)

LNAPE 24:3;O

C29H52NO9P (589.3379512)

LNAPE 25:2

C30H56NO8P (589.3743346)

PE O-18:0/7:3;O

C30H56NO8P (589.3743346)

PE O-23:5;O3

C28H48NO10P (589.3015677999999)

PE O-24:4;O2

C29H52NO9P (589.3379512)

PE O-25:3;O

C30H56NO8P (589.3743346)

PE P-16:0/8:3;O2

C29H52NO9P (589.3379512)

PE P-16:1/7:3;O3

C28H48NO10P (589.3015677999999)

PE P-16:1/8:2;O2

C29H52NO9P (589.3379512)

PE P-16:1/9:1;O

C30H56NO8P (589.3743346)

PE P-20:1/5:1;O

C30H56NO8P (589.3743346)

PE 14:0/9:4;O2

C28H48NO10P (589.3015677999999)

PE 16:0/8:3;O

C29H52NO9P (589.3379512)

PE 16:1/7:3;O2

C28H48NO10P (589.3015677999999)

PE 18:1/6:2;O

C29H52NO9P (589.3379512)

PE 18:3/5:1;O2

C28H48NO10P (589.3015677999999)

PE 20:2/4:1;O

C29H52NO9P (589.3379512)

PE 23:4;O2

C28H48NO10P (589.3015677999999)

PE 24:3;O

C29H52NO9P (589.3379512)

LNAPS 22:3

C28H48NO10P (589.3015677999999)

PS O-22:4;O

C28H48NO10P (589.3015677999999)

PS P-16:1/6:2;O

C28H48NO10P (589.3015677999999)

PS P-18:1/4:2;O

C28H48NO10P (589.3015677999999)

LPS 22:4;O

C28H48NO10P (589.3015677999999)

PS 18:2/4:1

C28H48NO10P (589.3015677999999)

PS 18:3/4:0

C28H48NO10P (589.3015677999999)

PS 20:3/2:0

C28H48NO10P (589.3015677999999)

PS 22:3

C28H48NO10P (589.3015677999999)

ST 20:0;O7;HexNAc

C28H47NO12 (589.3098102)

ST 23:5;O5;HexNAc

C31H43NO10 (589.2886818000001)

ST 24:4;O4;HexNAc

C32H47NO9 (589.3250652)

ST 25:3;O3;HexNAc

C33H51NO8 (589.3614486)

ST 26:2;O7;Tau

C28H47NO10S (589.2920522000001)

ST 27:1;O6;Tau

C29H51NO9S (589.3284356)

ST 28:0;O5;Tau

C30H55NO8S (589.364819)

1,10,24,26,27-pentahydroxy-6,20,24-trimethyl-12-oxa-18-azaheptacyclo[13.12.0.0²,¹³.0⁵,¹⁰.0⁶,¹³.0¹⁶,²⁵.0¹⁸,²³]heptacosan-9-yl 2-methylbut-2-enoate

C33H51NO8 (589.3614486)

2-{4-carboxy-7-[(2-hydroxy-2,5,5,8a-tetramethyl-hexahydro-1h-naphthalen-1-yl)methoxy]-5-methoxy-6-methyl-1-oxo-3h-isoindol-2-yl}pentanedioic acid

C31H43NO10 (589.2886818000001)

(2r,3s)-n-[(2z,5r,6r,7s)-7-[(3s,5z,8s,9r)-9,14-dihydroxy-12-methoxy-8-methyl-1-oxo-3,4,7,8,9,10-hexahydro-2-benzoxacyclododecin-3-yl]-6-hydroxy-5-methyloct-2-en-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)

n-[(2z,10z)-6,8-dihydroxy-13-(8-hydroxy-6-methoxy-1-oxo-3,4-dihydro-2-benzopyran-3-yl)-5,7-dimethyltetradeca-2,10-dien-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)

(4r)-n-[(1s,4r)-4-isopropyl-2-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C33H43N5O5 (589.3264028)

3-[4-(acetyloxy)-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-(2,3,3-trimethyloxiran-2-yl)butan-2-yl pyridine-3-carboxylate

C36H47NO6 (589.3403202)

(1s,3r,4r,6s,7s,8r,10r,13r,14r,16s,17s,18r)-5,7,8,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

C31H43NO10 (589.2886818000001)

benzoylmesaconitine

C31H43NO10 (589.2886818000001)

{"Ingredient_id": "HBIN017823","Ingredient_name": "benzoylmesaconitine","Alias": "NA","Ingredient_formula": "C31H43NO10","Ingredient_Smile": "CN1CC2(C(CC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC)OC)O)COC","Ingredient_weight": "589.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6364","PubChem_id": "122173204","DrugBank_id": "NA"}

2-({2-[(2-{[2-({2-[(2-amino-1-hydroxypropylidene)amino]-1-hydroxyethylidene}amino)-1-hydroxy-3-methylbutylidene]amino}-1,3-dihydroxybutylidene)amino]-1,3-dihydroxypropylidene}amino)-5-carbamimidamidopentanoic acid

C23H43N9O9 (589.3183588)

(4r,7r)-n-[(1s,2s,4r,7s)-2-hydroxy-4-isopropyl-7-[(2s)-2-methylbutyl]-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C33H43N5O5 (589.3264028)

(2r,5s,8s,11s)-3,12-dihydroxy-11-[(4-hydroxyphenyl)methyl]-10-methyl-2,5,8-tris(2-methylpropyl)-1,7-dioxa-4,10,13-triazacyclohexadeca-3,12-diene-6,9,16-trione

C31H47N3O8 (589.3362982)

(2r,3s)-3-[(1r,3as,3bs,4r,9ar,9bs,11ar)-4-(acetyloxy)-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-[(2s)-2,3,3-trimethyloxiran-2-yl]butan-2-yl pyridine-3-carboxylate

C36H47NO6 (589.3403202)

n-[4-isopropyl-2-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C33H43N5O5 (589.3264028)

(1r,3as,3bs,4r,9ar,9bs,11ar)-9a,11a-dimethyl-7-oxo-1-[(1s)-1-[(1s,3r,5r)-5,6,6-trimethyl-1-(pyridin-3-yl)-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

C36H47NO6 (589.3403202)

2-phenyl-n-[(2r,3s,6s,9r)-4,7,10-trihydroxy-9-(1h-indol-3-ylmethyl)-2-methyl-6-(2-methylpropyl)-14-oxo-1-oxa-5,8,11-triazacyclotetradeca-4,7,10-trien-3-yl]ethanimidic acid

C32H39N5O6 (589.2900194)

2-{7-carboxy-4-[(2-hydroxy-2,5,5,8a-tetramethyl-hexahydro-1h-naphthalen-1-yl)methoxy]-6-methoxy-5-methyl-1-oxo-3h-isoindol-2-yl}pentanedioic acid

C31H43NO10 (589.2886818000001)

(1r,3as,3bs,5as,7s,9ar,9bs,11as)-9a,11a-dimethyl-1-[(2s)-1-[(4r)-4-methyl-4,5-dihydro-3h-pyrrol-2-yl]-1-oxopropan-2-yl]-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-tetradecahydrocyclopenta[a]phenanthren-5-one

C33H51NO8 (589.3614486)

(4s,7r)-n-[(1s,2s,4r,7s)-4-isopropyl-2-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C33H43N5O5 (589.3264028)

n-(1-{[1-({1-[(1-hydroxy-3-phenylpropan-2-yl)-c-hydroxycarbonimidoyl]-1-methylethyl}-c-hydroxycarbonimidoyl)-3-methylbutyl]-c-hydroxycarbonimidoyl}-1-methylethyl)-2-[(1-hydroxyethylidene)amino]-4-methylpentanimidic acid

C31H51N5O6 (589.3839146)

(1s,2s,5s,6s,9s,10s,13r,15s,16s,20s,23s,24s,25r,26r,27s)-1,10,24,26,27-pentahydroxy-6,20,24-trimethyl-12-oxa-18-azaheptacyclo[13.12.0.0²,¹³.0⁵,¹⁰.0⁶,¹³.0¹⁶,²⁵.0¹⁸,²³]heptacosan-9-yl (2z)-2-methylbut-2-enoate

C33H51NO8 (589.3614486)

9a,11a-dimethyl-7-oxo-1-{1-[5,6,6-trimethyl-1-(pyridin-3-yl)-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl}-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

C36H47NO6 (589.3403202)

9a,11a-dimethyl-1-[1-(4-methyl-4,5-dihydro-3h-pyrrol-2-yl)-1-oxopropan-2-yl]-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-tetradecahydrocyclopenta[a]phenanthren-5-one

C33H51NO8 (589.3614486)

11-hydroxy-14-{[1-(6-hydroxy-2,6-dimethyl-4-oxoheptan-2-yl)imidazol-4-yl]methylidene}-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.0¹,¹³.0³,⁸]hexadeca-3,5,7,10-tetraene-12,15-dione

C32H39N5O6 (589.2900194)

(2r,3s)-n-[(2z,5r,6r,7r,8s,10z,13s)-6,8-dihydroxy-13-[(3r)-8-hydroxy-6-methoxy-1-oxo-3,4-dihydro-2-benzopyran-3-yl]-5,7-dimethyltetradeca-2,10-dien-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)

(1r,3as,3bs,5as,7s,9ar,9bs,11as)-9a,11a-dimethyl-1-[(2r)-1-[(4r)-4-methyl-4,5-dihydro-3h-pyrrol-2-yl]-1-oxopropan-2-yl]-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-tetradecahydrocyclopenta[a]phenanthren-5-one

C33H51NO8 (589.3614486)

n-[6,8-dihydroxy-13-(8-hydroxy-6-methoxy-1-oxo-3,4-dihydro-2-benzopyran-3-yl)-5,7-dimethyltetradeca-2,10-dien-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)

(4r,7r)-n-[(1s,2s,4r,7s)-4-isopropyl-2-methoxy-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C33H43N5O5 (589.3264028)

(2s)-2-{[(2s)-2-{[(2s,3r)-2-{[(2s)-2-[(2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-1-hydroxyethylidene)amino]-1-hydroxy-3-methylbutylidene]amino}-1,3-dihydroxybutylidene]amino}-1,3-dihydroxypropylidene]amino}-5-carbamimidamidopentanoic acid

C23H43N9O9 (589.3183588)

n-[7-(9,14-dihydroxy-12-methoxy-8-methyl-1-oxo-3,4,7,8,9,10-hexahydro-2-benzoxacyclododecin-3-yl)-6-hydroxy-5-methyloct-2-en-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)

2-(4-{[(1s,2r,4as,8as)-2-hydroxy-2,5,5,8a-tetramethyl-hexahydro-1h-naphthalen-1-yl]methoxy}-7-carboxy-6-methoxy-5-methyl-1-oxo-3h-isoindol-2-yl)pentanedioic acid

C31H43NO10 (589.2886818000001)

2-(7-{[(1s,2r,4as,8as)-2-hydroxy-2,5,5,8a-tetramethyl-hexahydro-1h-naphthalen-1-yl]methoxy}-4-carboxy-5-methoxy-6-methyl-1-oxo-3h-isoindol-2-yl)pentanedioic acid

C31H43NO10 (589.2886818000001)

(1s,2s,3s,4r,5r,6s,8r,9s,10r,13s,14r,16s,17r)-11-ethyl-5,6,8,14,17-pentahydroxy-16-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate

C31H43NO10 (589.2886818000001)

2-phenyl-n-[4,7,10-trihydroxy-9-(1h-indol-3-ylmethyl)-2-methyl-6-(2-methylpropyl)-14-oxo-1-oxa-5,8,11-triazacyclotetradeca-4,7,10-trien-3-yl]ethanimidic acid

C32H39N5O6 (589.2900194)

(1r,2s,3r,4r,5s,6s,7r,8r,10r,13r,14r,16r,17s,18r)-5,7,8,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

C31H43NO10 (589.2886818000001)

3,12-dihydroxy-11-[(4-hydroxyphenyl)methyl]-10-methyl-2,5,8-tris(2-methylpropyl)-1,7-dioxa-4,10,13-triazacyclohexadeca-3,12-diene-6,9,16-trione

C31H47N3O8 (589.3362982)

(1s,9r,14e)-11,15-dihydroxy-14-{[1-(6-hydroxy-2,6-dimethyl-4-oxoheptan-2-yl)imidazol-4-yl]methylidene}-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.0¹,¹³.0³,⁸]hexadeca-3,5,7,10,15-pentaen-12-one

C32H39N5O6 (589.2900194)

n-[(2z)-7-[(5z)-9,14-dihydroxy-12-methoxy-8-methyl-1-oxo-3,4,7,8,9,10-hexahydro-2-benzoxacyclododecin-3-yl]-6-hydroxy-5-methyloct-2-en-1-yl]-3-hydroxy-2-methylhexanimidic acid

C33H51NO8 (589.3614486)