StructureChemical NameCASMF
(2R,2'R,2''R,3R,3'R,3''S,4β,4'β)-2α,2'α,2''α-Tris(3,4-dihydroxyphenyl)-3,3',3'',4,4',4''-hexahydro-3'-(galloyloxy)-4,8':4',8''-ter[2H-1-benzopyran]-3,3'',5,5',5'',7,7',7''-octol
Verbascoside 61276-17-3 C29H36O15
Angoroside C 115909-22-3 C36H48O19
1-Deoxynojirimycin 19130-96-2 C6H13NO4
(2R,4R,5R,6R)-4-[(2R,4R,5R,6R)-2-carboxy-6-[(1R)-1,2-dihydroxyethyl]-4 ,5-dihydroxy-oxan-2-yl]oxy-6-[(1R)-1,2-dihydroxyethyl]-5-hydroxy-2-[[( 2R,3S,4R,5R,6R)-6-[[(2R,3S,4R,5R,6R)-3-hydroxy-5-[[(3R)-3-hydroxytetra decanoyl]amino]-4-[(3R)-3-hydroxytetradecanoyl]oxy-6-phosphonooxy-oxan -2-yl]methoxy]-5-[[(3R)-3-hydroxytetradecanoyl]amino]-4-[(3R)-3-hydrox ytetradecanoyl]oxy-3-phosphonooxy-oxan-2-yl]methoxy]oxane-2-carboxylic acid 143600-83-3 C84H154N2O37P2
(2R,3R,4R,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxymethyl]-2-[4-(hydrazinecarbonyl)pyridin-1-yl]-4-hydroxy-oxolan-3-olate 2668-07-7 C21H28N8O14P2
D-Sorbitol 98201-93-5 C6H14O6
[(2R,3R,4R,5R)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4,5-d iphosphonooxy-oxan-2-yl]oxy-5-(6-aminopurin-9-yl)-4-hydroxy-oxolan-2-y l]methoxyphosphonic acid 149091-93-0 C18H28N5O19P3
(8R,11R,12R,16RS)-Misoprostol Acid-d5 C21H36O5
(8R,11R,12R,16RS)-Misoprostol-d5 C22H38O5
(1R,2R,4R,5R,7S)-5-Hydroxy-5,8,8-trimethyl-3-oxatricyclo[5.1.0.02,4]octane-6-one C10H14O3
(5R,6R,14R)-7β-[(S)-1-Isothiocyanatoethyl]-4,5-epoxy-3,6β-dimethoxy-17-methyl-6,14-ethenomorphinan
(6R,14R,22R,30R,32S,34S)-6,14,22,30,32,34-Hexahydroxy-8,16,24-pentatriacontanetrione 87879-55-8 C35H66O9
(5R,6R,14R)-7β-[(S)-1-Isothiocyanatoethyl]-4,5-epoxy-6β-methoxy-17-methyl-6,14-ethenomorphinan-3-ol
(2R,3R,4R,5S)-2,3-Isopropylidenebisoxy-5-[(S)-1-(methoxyphenylphosphinyl)-2-[(tetrahydro-2H-pyran)-2-yl]ethyl]-4-acetoxytetrahydrofuran C23H33O8P
(2R,3R,4R,5R,6S)-7-[[(tert-Butyl)dimethylsilyl]oxy]-3,5-(isopropylidenebisoxy)-1-[(p-methoxybenzyl)oxy]-2,4,6-trimethylheptane C27H48O5Si
Netilmicin sulfate 56391-57-2 C42H92N10O34S5
(4R)-4-[(3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 39016-49-4 C24H40O5
2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid 516-90-5 C26H45NO5S
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-sulfooxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 34669-57-3 C24H40O6S
(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-[(1R)-1-aminoethyl]oxan-2-yl]oxy-2-hydroxy-cyclohexyl]oxy-5-methyl-4-methylamino-oxane-3,5-diol 25876-11-3 C20H41N5O7
(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-[(1R)-1-methylaminoethyl]oxan-2-yl]oxy-2-hydroxy-cyclohexyl]oxy-5-methyl-4-methylamino-oxane-3,5-diol 25876-10-2 C21H43N5O7
(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-disulfooxy-2,] 67030-51-7 C24H40O10S2
(2R,3R,4R,5R)-4-[(2S,3R,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,3,5,6-tetrahydroxyhexanal 32694-82-9 C18H32O16
(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4,6-dihydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol 137252-15-4 C27H48O5
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid 5130-29-0 C24H38O4
(4R)-4-[(3R,5R,8R,9S,10S,12R,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 570-62-7 C24H40O4
(3R,5R,7R,8R,9S,10R,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-17-[(] 863-39-8 C28H48O5
2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-sulfooxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid 15324-64-8 C26H43NO7S
(8R,12R,11R,16RS)-Misoprostol-d5 C22H33D5O5
(3R,5R,7R,8R,9S,10S,12S,13R,14S)-3,7,12-trihydroxy-17-[(2R)-6-(hydroxymethyl)-7-sulfooxy-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene 53939-18-7 C27H48O8S
(1r,3r,5r,7r)-6-tosyl-2-oxa-6-azaadaMantane 35986-02-8 C15H19NO3S
[2R,4R,6R,8R,(-)]-2,4,6,8-Tetramethyloctacosanoic acid methyl ester 27829-61-4 C33H66O2
(4R,5R,13R,14R)-4,5,13,14-Tetramethyl-3,6,9,12,15-pentaoxa-21-azabicyclo[15.3.1]henicosane-1(21),17,19-triene C19H31NO5
(2R,3R,4R,5R)-1,3,5,6-Tetrabromo-2,4-hexanediol C6H10Br4O2
(2R,4R,6R,8R)-4,6,8-Trimethylundecane-2-ol formate 83540-84-5
(2R,2'R,6R,6'R)-5,5',18,18'-Tetradehydro-5,5',6,6'-tetrahydro-2,2'-bis[(E)-4-hydroxy-3-methyl-2-butenyl]-β,β-carotene 11031-47-3 C50H72O2
(3R)-3-[(2R)-6β-[(1R,2R)-1-tert-Butylsulfonyloxy-2-(4-methoxybenzyloxy)-1-methylbutyl]-2α-(2,4,6-trimethylphenyl)-5α-methyl-1,3-dioxan-4β-yl]butyraldehyde
(1R,2R,3R,4R)-1,2,3,4-Tetrahydro-1β,2β,3α,4α,5,6,7,8-octafluoro-1,2-[(1S,2S)-indane-1,2-diyl]-3,4-[(1R,2R)-indane-1,2-diyl]naphthalene
(3R,5R,9R,14R)-3,7,9,13-Tetramethyl-14-ethyl-11-methylene-5-hydroxy-5-(hydroxymethyl)oxacyclotetradeca-7,12-diene-2,4-dione 124027-87-8 C21H32O5
[2R,4R,6R,8R,(-)]-2,4,6,8-Tetramethyl-13-tetradecenoic acid methyl ester 27829-59-0 C19H36O2
(2R,4R,6R,8R)-2,4,6,8-Tetramethyl-1-octacosanol 27829-63-6 C32H66O
(2R,3R,4R,5R)-2,3,4,5-Tetrahydroxy-6-oxohexanoic acid C6H10O7
(1R,2R,3R,5R)-(2-TERT-BUTOXYCARBONYLAMINO)-6,6-DIMETHYLBICYCLO[3.1.1]HEPTAN-3-CARBOXYLIC ACID 1027343-75-4 C15H25NO4
2(R),4(R),6(R),8(R)-TETRAMETHYLDECANOL C14H30O
2(R),4(R),6(R),8(R)-TETRAMETHYLDECANOIC ACID C14H28O2
(3R,4R,5R,6R)-3,4,5,6-TETRAHYDROXYAZEPANE HCL 178964-40-4 C6H13NO4
2(R),4(R),6(R),8(R)-TETRAMETHYLUNDECANOIC ACID C15H30O2
2(R),4(R),6(R),8(R)-TETRAMETHYLUNDECANOL C15H32O
2(R),4(R),6(R),8(R)-TETRAMETHYLDECYL 2(R),4(R),6(R),8(R)-TETRAMETHYLDECANOATE C28H56O2
[R-(R*,R*)]-tartaric acid, sodium zirconium salt 94536-69-3 C4H7NaO6Zr
[R-(R*,R*)]-tartaric acid, potassium salt 40968-90-9 C4H4K2O6
[R-(R*,R*)]-tartaric acid, indium(3+) salt 60815-94-3 C12H12In2O18
[R-(R*,R*)]-tartaric acid, iron potassium salt 14948-71-1 C8H8FeKO12
[R-(R*,R*)]-tartaric acid, potassium zirconium salt 94386-15-9 C20H20K2O30Zr2
[R-(R*,R*)]-tartaric acid, manganese salt 14998-36-8 C4H6MnO6
[R-(R*,R*)]-tartaric, acid iron(3+) salt 30386-85-7 C12H12Fe2O18
[R-(R*,R*)]-tartaric acid, sodium salt 14475-11-7 C4H7NaO6
(2R,3R,5R,11S)-3,11-Methanoaspidofractinin-22-one 6662-83-5 C20H22N2O
(1R,4R,6R,2'S)-2'-Methylspiro[bornane-6,5'(2'H)-furan]
[1R,2R,3R,4S,(-)]-2-(Methoxycarbonyl)bicyclo[2.2.1]hepta-5-ene-3-carboxylic acid C10H12O4
[1R,2R,3R,4S]-2-(Methoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid C9H12O5
(2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol 8065-20-1 C29H34I6N5NaO13
(2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol, 2-[2,4,6-triiodo-3 ,5-bis(methylcarbamoyl)phenoxy]octanoic acid 19080-51-4 C25H40I3N3O10
(2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol 37244-85-2 C31H38I6N5NaO15
(2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol 72704-51-9 C29H35I6N3O14
(2R,3R,4R,5S)-6-methylaminohexane-1,2,3,4,5-pentol, 2-[2,4,6-triiodo-3 ,5-bis(methylcarbamoyl)phenoxy]pentanoic acid 19080-48-9 C22H34I3N3O10
(3R,4R,5S)-3-Hydroxy-4-[4-[[(2S)-3-methoxy-2-methylpropoxy]methyl]phenyl]-5-[(triphenylmethoxy)methyl]-1-piperidinecarboxylic acid phenylmethyl ester 1018478-41-5 C45H49NO6
(4R)-3-[(2R,3S)-3-Hydroxy-1-oxo-2-(2-propen-1-yl)-4-penten-1-yl]-4-(phenylMethyl)-2-oxazolidinone 1005006-69-8 C18H21NO4
(5R)-5-[(2R,4S)-4-Hydroxypentan-2-yl]-2,2-dimethyltridecan-3-one C20H40O2
(4R,8R,12R)-4,8,12,16-Tetramethylheptadecanoic acid methyl ester 34656-31-0 C22H44O2
(5β,8R,10α,13R,14S)-3α-Hydroxy-14-(tigloyloxy)beyer-15-en-18-al
(5R,6R,7S)-6-Hydroxy-3,3,5-trimethyl-7-phenyl-1-octen-4-one C17H24O2
(2R,3R)-1-[(1S)-1-Hydroxy-3-methylbutyl]-3α-benzyloxy-2α-(4-fluorophenyl)azetidine
5-[(1R,5R,8S)-8-Hydroxy-1,5-dimethyl-3-oxo-6-oxabicyclo[3.2.1]octan-8-yl]-3-methyl-2,4-pentadienoic acid methyl ester 41670-48-8 C16H22O5
(R)-1-[(4R,4'R)-2,2,2',2'-Tetramethyl-4α,4'β-bi[1,3-dioxolane]-5β-yl]ethane-1,2-diol 38145-93-6
(4R,6R,7S)-7-Hydroxy-4,6-dimethyl-3-nonanone C11H22O2
(4R,5R,αR)-1,3,4,5-Tetrahydro-4-(methylamino)-α-(1-methylethenyl)benz[cd]indole-5-methanol 52052-66-1 C16H20N2O
(2R)-3-[(2R,4S)-2α-Hydroxy-4β-(β-D-glucopyranosyloxy)-6,6-dimethylcyclohexane-1-ylidene]propenal 109062-00-2 C19H30O8
(2R,3R)-1-[(1S)-1-Hydroxymethyl-3-methylbutyl]-2α-phenylazetidin-3α-ol
(1R,5R,6S)-6-Iodo-2-(iodomethylene)-7,7-dimethyl-1-(2-propenyl)bicyclo[3.3.0]octan-3-one C14H18I2O
(5R)-5-[(2R,4S)-4-Hydroxypentan-2-yl]-2,2-dimethyl-5-phenylpentan-3-one C18H28O2
(2R,3R,4R)-2-(tert-Butyldimethylsilyloxy)-4-methyl-5-hexen-3-ol C13H28O2Si
(4R,5R,6S)-6-(1-hydroxyethyl)-3-[(3S,5S)-5-[(1R)-1-hydroxy-3-methylamino-propyl]pyrrolidin-3-yl]sulfanyl-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 149951-16-6 C18H29N3O5S
[R(R*,S*)]-3-[(2-hydroxy-1-methyl-2-phenylethyl)methylamino]propiononitrile monohydrochloride 40658-23-9 C13H19ClN2O
(4R,6R,7S)-2-IODO-9,9-DIMETHYL-5,8,10-TRI-OXATRICYCLO-[5.4.0.0]UNDEC-1-EN-3-ONE
[R-(R*,S*)]-3-[(2-hydroxy-1-methyl-2-phenylethyl)amino]-3'-methoxypropiophenone hydrochloride 16777-42-7 C19H24ClNO3
[R-(R*,S*)]-(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium (1S)-2-oxobornane-10-sulphonate 84415-23-6 C21H33NO5S
(3R,7R,11R)-3,7,11,15-tetramethylhexadecanoic acid 18654-64-3 C20H40O2
(2R,4S)-4-(2H-tetrazol-5-ylmethyl)piperidine-2-carboxylic acid 125546-04-5 C8H13N5O2
[1R,2R,4R,5S,(-)]-p-Menthane-2,5-diol C10H20O2
(1R,4R,6R)-Spiro[bornane-6,5'(2'H)-furan]
[(2R,3R,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphonic acid 46495-39-0 C6H13O9P
(1R,5R,6R,7S)-rel-4-Oxo-8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-2-ene-6,7-dicarboxylicacid6,7-dimethylester 960201-81-4 C18H19NO5
(2R,3R,4R,5S,6R)-2-phenethoxy-6-((((3R,4R,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)Methoxy)Methyl)tetrahydro-2H-pyran-3,4,5-triol C20H30O10
2-[(2R,4R,6R,10S,12R,13R)-10,13-Bis(acetyloxy)-4,15-dimethyl-8-oxo-3,7,17-trioxatetracyclo[12.2.1.16,9.02,4]octadeca-9(18),14,16(1)-trien-12-yl]acrylic acid methyl ester 134455-96-2 C25H28O10
(4R,12R,20R,24S,26R,28R)-4,12,20,24,26,28-Hexahydroxy-2,10,18-tritriacontanetrione 88212-13-9
Telithromycin 191114-48-4 C43H65N5O10
(4R)-4-[(3R,4R,5S,8R,9S,10R,12S,13R,14S,17R)-3,4,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 129012-50-6 C24H40O5
2-[[(4R)-4-[(3R,5R,6S,7R,10R,13R,17R)-3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid 25696-60-0 C26H45NO7S
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