All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
4044 7-[(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)oxy]-3',5-dihydroxy-4'-methoxyflavone 7-[(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)oxy]-3',5-dihydroxy-4'-methoxyflavone 7-[(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)oxy]-3',5-dihydroxy-4'-methoxyflavone C27H30O15 594.158 InChIKey=IXWDYBPIGZKUPJ-MUCJXJSVSA-N No Yes
4045 Ambuic acid Ambuic acid Ambuic acid C19H26O6 350.173 InChIKey=UDSQZJMGPSRCEM-ANKZSMJWSA-N No Yes
4046 Andrograpanin Andrograpanin Andrograpanin C20H30O3 318.219 InChIKey=WKKBRRFSRMDTJB-JYBIWHBTSA-N No Yes
4047 Andrograpanin acetate Andrograpanin acetate Andrograpanin acetate C22H32O4 360.230 InChIKey=IJVIKNXNFILSIN-WKDRNLAYSA-N No Yes
4048 19-Acetoxy-20-oxo-8(17),13-ent-labdadien-15-->16 lactone 19-Acetoxy-20-oxo-8(17),13-ent-labdadien-15-->16 lactone 19-Acetoxy-20-oxo-8(17),13-ent-labdadien-15-->16 lactone C22H30O5 374.209 InChIKey=WYONPMFSPVLPSA-KRXUUXHPSA-N No Yes
4049 Neoandrographolide Neoandrographolide Neoandrographolide C26H40O8 480.272 InChIKey=YGCYRQKJYWQXHG-RDNQFMDVSA-N No Yes
4050 (6'-Acetyl) 19-B-D-glucopyranosyloxy-8(17),13-entlabdadien-15-->16-lactone (6'-Acetyl) 19-B-D-glucopyranosyloxy-8(17),13-entlabdadien-15-->16-lactone (6'-Acetyl) 19-B-D-glucopyranosyloxy-8(17),13-entlabdadien-15-->16-lactone C28H42O9 522.283 InChIKey=LIIMOJLTWWSQGN-HDWGBIQKSA-N No Yes
4051 8(17),13-ent-Labdadien-15-->16,19-->20 dolactone 8(17),13-ent-Labdadien-15-->16,19-->20 dolactone 8(17),13-ent-Labdadien-15-->16,19-->20 dolactone C20H26O4 330.183 InChIKey=WOJFQQBABNELSQ-YAJHFMINSA-N No Yes
4052 2A-Acetoxy-15-isovaleryl-miguanin 2A-Acetoxy-15-isovaleryl-miguanin 2A-Acetoxy-15-isovaleryl-miguanin C22H28O8 420.178 InChIKey=PKRVXIIZNSTWTA-JLSYYUQOSA-N No Yes
4053 2A-acetoxy-15-(2-methylbutyryl)-miguanin 2A-acetoxy-15-(2-methylbutyryl)-miguanin 2A-acetoxy-15-(2-methylbutyryl)-miguanin C22H28O8 420.178 InChIKey=LTIMCRDLRYFHGE-MTRPDENSSA-N No Yes
4055 15-Isovalery-miguanin 15-Isovalery-miguanin 15-Isovalery-miguanin C20H26O6 362.173 InChIKey=PYXDBFWTGFQZMF-KFRBSINHSA-N No Yes
4056 15-(2-methylbutyryl)-miguanin 15-(2-methylbutyryl)-miguanin 15-(2-methylbutyryl)-miguanin C20H26O6 362.173 InChIKey=QHGKREFYCJPLAM-LBGQIVEFSA-N No Yes
4057 9A,14-Dihydroxy-15-isobutyryloxy-costunolide 9A,14-Dihydroxy-15-isobutyryloxy-costunolide 9A,14-Dihydroxy-15-isobutyryloxy-costunolide C19H26O6 350.173 InChIKey=RVKFWBVDFTVESX-ZJWSFZNISA-N No Yes
4058 14-Hydroxy-15-isovalery“oxy-9-oxo-melampolide 14-Hydroxy-15-isovalery“oxy-9-oxo-melampolide 14-Hydroxy-15-isovalery“oxy-9-oxo-melampolide C20H26O6 362.173 InChIKey=PYXDBFWTGFQZMF-KFRBSINHSA-N No Yes
4059 Aralia-saponin V Aralia-saponin V Aralia-saponin V C54H88O23 1104.572 InChIKey=MROYUZKXUGPCPD-ZROVLDGGSA-N No Yes
4060 Aralia-saponin VI Aralia-saponin VI Aralia-saponin VI C54H88O24 1120.567 InChIKey=OIMHYZAWACXBBH-PQYOORDQSA-N No Yes
4061 Aralia-saponin VII Aralia-saponin VII Aralia-saponin VII C54H88O24 1120.567 InChIKey=UGNSVPOBELCKQM-FUVSWSFHSA-N No Yes
4062 Aralia-saponin VIII Aralia-saponin VIII Aralia-saponin VIII C60H98O30 1298.614 InChIKey=ZDHYHPKLGQQGAP-SKGSEMOBSA-N No Yes
4063 Aralia-saponin IX Aralia-saponin IX Aralia-saponin IX C53H86O23 1090.556 InChIKey=VSHKQUCHQMFIEG-JYQCYINDSA-N No Yes
4064 3,3a,5,6,9,9a-Hexahydro-1-(1,5-dimethyl-4,5-dihydroxyhexyl)-3a-methyl-7-hydroxycyclopenta[b][1]benzopyran-8(7H)-one 3,3a,5,6,9,9a-Hexahydro-1-(1,5-dimethyl-4,5-dihydroxyhexyl)-3a-methyl-7-hydroxycyclopenta[b][1]benzopyran-8(7H)-one 3,3a,5,6,9,9a-Hexahydro-1-(1,5-dimethyl-4,5-dihydroxyhexyl)-3a-methyl-7-hydroxycyclopenta[b][1]benzopyran-8(7H)-one C21H32O5 364.225 InChIKey=QQLTWWDUOUVAFG-UHFFFAOYSA-N No Yes
4065 Dimethoxychalepensin Dimethoxychalepensin Dimethoxychalepensin C18H18O5 314.115 InChIKey=KHRPPPVMZUBIOV-UHFFFAOYSA-N No Yes
4066 (8-Geranoxy-5-methoxypsoralen (8-Geranoxy-5-methoxypsoralen (8-Geranoxy-5-methoxypsoralen C22H24O5 368.162 InChIKey=CTPXXQMJFXTTQZ-XNTDXEJSSA-N No Yes
4067 Cnidilin Cnidilin Cnidilin C17H16O5 300.100 InChIKey=NNDOCYLWULORAM-UHFFFAOYSA-N No Yes
4068 4-Methoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one 4-Methoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one 4-Methoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one C17H16O4 284.105 InChIKey=YITFANBGOUYLGN-UHFFFAOYSA-N No Yes
4069 4,9-Dimethoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one 4,9-Dimethoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one 4,9-Dimethoxy-6-(3-methyl-2-butenyl)-7H-furo[3,2-g][1]benzopyran-7-one C18H18O5 314.115 InChIKey=OHPPUYMAEOCFNJ-UHFFFAOYSA-N No Yes
4070 Swietenocoumarin F Swietenocoumarin F Swietenocoumarin F C17H18O6 318.110 InChIKey=CRAONLIHLOSKGE-UHFFFAOYSA-N No Yes
4071 5-methoxy-3-(3-methyl-2,3-dihydroxybutyl)psoralen 5-methoxy-3-(3-methyl-2,3-dihydroxybutyl)psoralen 5-methoxy-3-(3-methyl-2,3-dihydroxybutyl)psoralen C17H18O6 318.110 InChIKey=DAVFRMKSTZLULF-UHFFFAOYSA-N No Yes
4072 4,9-Dimethoxy-6-(2,3-dihydroxy-3-methylbutyl)-7H-furo[3,2-g][1]benzopyran-7-one 4,9-Dimethoxy-6-(2,3-dihydroxy-3-methylbutyl)-7H-furo[3,2-g][1]benzopyran-7-one 4,9-Dimethoxy-6-(2,3-dihydroxy-3-methylbutyl)-7H-furo[3,2-g][1]benzopyran-7-one C18H20O7 348.121 InChIKey=ZGVWUTLWBHFMNG-UHFFFAOYSA-N No Yes
4073 4-Methoxy-9-(2,3-dihydroxy-1,1-dimethylpropyl)-7H-furo[3,2-g][1]benzopyran-7-one 4-Methoxy-9-(2,3-dihydroxy-1,1-dimethylpropyl)-7H-furo[3,2-g][1]benzopyran-7-one 4-Methoxy-9-(2,3-dihydroxy-1,1-dimethylpropyl)-7H-furo[3,2-g][1]benzopyran-7-one C17H18O6 318.110 InChIKey=PEIKVIYNHNSILV-UHFFFAOYSA-N No Yes
4074 5-(3-Methyl-2-butenyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-(3-Methyl-2-butenyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-(3-Methyl-2-butenyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one C17H16O4 284.105 InChIKey=VHPLQIPIBDLSOK-UHFFFAOYSA-N No Yes
4075 5-(2,3-Dihydroxy-3-methylbutyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-(2,3-Dihydroxy-3-methylbutyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-(2,3-Dihydroxy-3-methylbutyl)-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one C17H18O6 318.110 InChIKey=LPFGEJHDAXBPLK-UHFFFAOYSA-N No Yes
4076 5-[2-Hydroxy-3-methyl-3-(beta-D-glucopyranosyloxy)butyl]-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-[2-Hydroxy-3-methyl-3-(beta-D-glucopyranosyloxy)butyl]-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one 5-[2-Hydroxy-3-methyl-3-(beta-D-glucopyranosyloxy)butyl]-6-methoxy-2H-furo[2,3-h][1]benzopyran-2-one C23H28O11 480.163 InChIKey=KAGDTEFAQXXXMS-LSYPXDBQSA-N No Yes
4077 6-Methoxy-5-(3-hydroxy-2-oxo-3-methyl-butyl)-angelicin 6-Methoxy-5-(3-hydroxy-2-oxo-3-methyl-butyl)-angelicin 6-Methoxy-5-(3-hydroxy-2-oxo-3-methyl-butyl)-angelicin C17H16O6 316.095 InChIKey=BINPGDKSILOOII-UHFFFAOYSA-N No Yes
4078 6-Methoxy-5-(4-hydroxy-3-methyl-but-2-enyl)-angelicin 6-Methoxy-5-(4-hydroxy-3-methyl-but-2-enyl)-angelicin 6-Methoxy-5-(4-hydroxy-3-methyl-but-2-enyl)-angelicin C17H16O5 300.100 InChIKey=AJKRAAXHMVEUPY-KMKOMSMNSA-N No Yes
4079 Dorstegin Dorstegin Dorstegin C16H12O4 268.074 InChIKey=ZPHRMAVWOHUQAA-UHFFFAOYSA-N No Yes
4080 (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid (2S,3R,4S)-3-ethenyl-4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid C25H33N1O11 523.205 InChIKey=SQIULMODQKFOOJ-ONGZBVEHSA-N No Yes
4081 (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-hydroxy-7-methoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-hydroxy-7-methoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-hydroxy-7-methoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid C25H33N1O11 523.205 InChIKey=XLTXRMBIJSESJQ-ONGZBVEHSA-N No Yes
4082 (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6,7-dimethoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6,7-dimethoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6,7-dimethoxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid C26H35N1O11 537.221 InChIKey=BTFMYVDAWDKTHJ-QIAPLWSDSA-N No Yes
4083 (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-methoxy-7-hydroxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(6-O-alpha-D-glucopyranosyl-beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-methoxy-7-hydroxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(6-O-alpha-D-glucopyranosyl-beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid (4S)-4beta-[(S)-1,2,3,4-Tetrahydro-6-methoxy-7-hydroxyisoquinoline-1-ylmethyl]-5beta-vinyl-6alpha-(6-O-alpha-D-glucopyranosyl-beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid C31H43N1O16 685.258 InChIKey=FTLMDSQFEONTKX-XWTXEBILSA-N No Yes
4084 (2S)-4alpha-[[(1R)-6-Methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline]-1beta-ylmethyl]-3alpha-ethenyl-2beta-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylic acid (2S)-4alpha-[[(1R)-6-Methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline]-1beta-ylmethyl]-3alpha-ethenyl-2beta-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylic acid (2S)-4alpha-[[(1R)-6-Methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline]-1beta-ylmethyl]-3alpha-ethenyl-2beta-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-5-carboxylic acid C25H33N1O11 523.205 InChIKey=SQIULMODQKFOOJ-MDXCLUIBSA-N No Yes
4086 Kaempferide triglycoside Kaempferide triglycoside Kaempferide triglycoside C34H42O20 770.227 InChIKey=DYZZIAIGKSRPMS-VYYFDYLYSA-N No Yes
4087 4-Feruloyl-5-caffeoylquinic acid 4-Feruloyl-5-caffeoylquinic acid 4-Feruloyl-5-caffeoylquinic acid C26H26O12 530.142 InChIKey=RKAYMOSEFYVEJU-DRFAHUGVSA-N No Yes
4088 Methyl 4-feruloyl-5-caffeoylquinate Methyl 4-feruloyl-5-caffeoylquinate Methyl 4-feruloyl-5-caffeoylquinate C27H28O12 544.158 InChIKey=RTLCSWCXZWROFK-YODDMHFOSA-N No Yes
4089 Cilistol A Cilistol A Cilistol A C28H40O5 456.288 InChIKey=BDZXFCPMKYCHFV-RTPVBUSBSA-N No Yes
4090 Cilistol B Cilistol B Cilistol B C29H42O5 470.303 InChIKey=JLPRPCIHUJESQL-JMXHCEIISA-N No Yes
4091 Cilistol D Cilistol D Cilistol D C29H42O5 470.303 InChIKey=JLPRPCIHUJESQL-LYQKBEMDSA-N No Yes
4092 Cilistol Q Cilistol Q Cilistol Q C34H50O10 618.340 InChIKey=YLFSQXACNXUGHD-ZTHPDOTOSA-N No Yes
4093 Cilistol G Cilistol G Cilistol G C28H42O6 474.298 InChIKey=DLJKJPONFBSXHR-BBZUTWRQSA-N No Yes
4094 Cilistol F Cilistol F Cilistol F C29H44O6 488.314 InChIKey=SMOWMBLPGOGZBI-RWVBCDQNSA-N No Yes
4095 2-Methyl-4-pyrone 2-Methyl-4-pyrone 2-Methyl-4-pyrone C6H6O2 110.037 InChIKey=NQOJWZRPLXJDPX-UHFFFAOYSA-N No Yes