All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
19059 Ligulasagitin A Ligulasagitin A Ligulasagitin A C19H24O6 348.157 InChIKey=GUUIDVPYVVFJMG-RLJSLNLTSA-N No Yes
19060 Ligulasagitin B Ligulasagitin B Ligulasagitin B C19H26O5 334.178 InChIKey=BQAANQJBTMDRLQ-PEHAGOIBSA-N No Yes
19061 Ligulasagitin C Ligulasagitin C Ligulasagitin C C19H26O5 334.178 InChIKey=ZYHQYKWIRIJDJT-VHOHBCSHSA-N No Yes
19062 Ligulasagitin D Ligulasagitin D Ligulasagitin D C30H38O6 494.267 InChIKey=BYLFPDQIZSDDBN-GLHDIFAMSA-N No Yes
19063 Ligulasagitin E Ligulasagitin E Ligulasagitin E C38H48O11 680.320 InChIKey=WTWWWFDZTUYRBG-MCQTWJMSSA-N No Yes
19064 8β-Hydroxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Hydroxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Hydroxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide C15H16O5 276.100 InChIKey=CNACNPCNCNCMOI-BXLXJPJESA-N No Yes
19065 8β-Methoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Methoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Methoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide C16H18O5 290.115 InChIKey=ZVXAHYFFUVSFIE-RCYILOBPSA-N No Yes
19066 8β-Ethoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Ethoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide 8β-Ethoxyeremophil-3,7(11)-diene-8α,12(6α,15)-diolide C17H20O5 304.131 InChIKey=WNKFDRIAIQEEOT-RBKFWEOPSA-N No Yes
19067 6beta-(2xi-Metylbutyryloxy)eremophil-3,7(11),8-triene-8,12-olide-15-oic acid methyl ester 6beta-(2xi-Metylbutyryloxy)eremophil-3,7(11),8-triene-8,12-olide-15-oic acid methyl ester 6beta-(2xi-Metylbutyryloxy)eremophil-3,7(11),8-triene-8,12-olide-15-oic acid methyl ester C21H26O6 374.173 InChIKey=LWGCQRKMFZQHHZ-JZFDDSBWSA-N No Yes
19068 3beta-Angeloyloxy-8-oxoeremophil-6(7)-ene-8alpha,12,15-dioic acid methyl ester 3beta-Angeloyloxy-8-oxoeremophil-6(7)-ene-8alpha,12,15-dioic acid methyl ester 3beta-Angeloyloxy-8-oxoeremophil-6(7)-ene-8alpha,12,15-dioic acid methyl ester C22H30O7 406.199 InChIKey=DDHBCBRLTQJJBD-VMUMOGIRSA-N No Yes
19069 2-Acetyl-3abeta-methyl-3a,6,7,7abeta-tetrahydro-1H-inden-4-oic acid methyl ester 2-Acetyl-3abeta-methyl-3a,6,7,7abeta-tetrahydro-1H-inden-4-oic acid methyl ester 2-Acetyl-3abeta-methyl-3a,6,7,7abeta-tetrahydro-1H-inden-4-oic acid methyl ester C14H18O3 234.126 InChIKey=FDIMCRDSRBAVOQ-RISCZKNCSA-N No Yes
19070 6β-Sarracinoyloxy-1β,10β-epoxyfuranoeremophilane 6β-Sarracinoyloxy-1β,10β-epoxyfuranoeremophilane 6β-Sarracinoyloxy-1β,10β-epoxyfuranoeremophilane C20H26O5 346.178 InChIKey=HIPQZGAHMOISRN-FOGDXZIMSA-N No Yes
19071 6alpha-Angeloyloxy-10betaH-furanoeremophil-1-one 6alpha-Angeloyloxy-10betaH-furanoeremophil-1-one 6alpha-Angeloyloxy-10betaH-furanoeremophil-1-one C20H26O4 330.183 InChIKey=WXXUTDJJIXJPLZ-QXPCPCOISA-N No Yes
19072 1alpha-hydroxy-9-deoxycacalol 1alpha-hydroxy-9-deoxycacalol 1alpha-hydroxy-9-deoxycacalol C15H18O2 230.131 InChIKey=ZRWPAGVTPFFNTL-UFBFGSQYSA-N No Yes
19073 1beta-Hydroxy-11(S)-8-oxoeremophil-6,9-dien-12-al 1beta-Hydroxy-11(S)-8-oxoeremophil-6,9-dien-12-al 1beta-Hydroxy-11(S)-8-oxoeremophil-6,9-dien-12-al C15H20O3 248.141 InChIKey=VPFADTWMSCOYGD-YJKIEOBBSA-N No Yes
19074 1beta-Hydroxy-11(R)-8-oxoeremophil-6,9-dien-12-al 1beta-Hydroxy-11(R)-8-oxoeremophil-6,9-dien-12-al 1beta-Hydroxy-11(R)-8-oxoeremophil-6,9-dien-12-al C15H20O3 248.141 InChIKey=VPFADTWMSCOYGD-UOJCWERNSA-N No Yes
19075 1-Hydroxyeremophil-7(11),9(10)-dien-8-one 1-Hydroxyeremophil-7(11),9(10)-dien-8-one 1-Hydroxyeremophil-7(11),9(10)-dien-8-one C15H22O2 234.162 InChIKey=QGDQQZUIBMCIHH-PSOPSSQASA-N No Yes
19076 1-Hydroxyeremophil-7(11),9(10)-dien-8-one 1-Hydroxyeremophil-7(11),9(10)-dien-8-one 1-Hydroxyeremophil-7(11),9(10)-dien-8-one C15H22O2 234.162 InChIKey=QGDQQZUIBMCIHH-VZJVUDMVSA-N No Yes
19077 3-Acetoxyeremophil-7(11),9-dien-8-one 3-Acetoxyeremophil-7(11),9-dien-8-one 3-Acetoxyeremophil-7(11),9-dien-8-one C17H24O3 276.173 InChIKey=RIMSRWLZAHVEPH-MZPVMMEZSA-N No Yes
19078 (3S)-3-Acetoxyeremophil-1,7(11),9-trien-8-one (3S)-3-Acetoxyeremophil-1,7(11),9-trien-8-one (3S)-3-Acetoxyeremophil-1,7(11),9-trien-8-one C17H22O3 274.157 InChIKey=FJZBAGIMAUDSAO-MZPVMMEZSA-N No Yes
19079 (4S,4aR)-4,4a,5,6,7,9-Hexahydro-3,4abeta,5beta-trimethylnaphtho[2,3-b]furan-4beta,6beta-diol 6-[(2Z)-2-methyl-2-butenoate] (4S,4aR)-4,4a,5,6,7,9-Hexahydro-3,4abeta,5beta-trimethylnaphtho[2,3-b]furan-4beta,6beta-diol 6-[(2Z)-2-methyl-2-butenoate] (4S,4aR)-4,4a,5,6,7,9-Hexahydro-3,4abeta,5beta-trimethylnaphtho[2,3-b]furan-4beta,6beta-diol 6-[(2Z)-2-methyl-2-butenoate] C20H26O4 330.183 InChIKey=UBSPYRWVKFNYNH-FXOXCMJQSA-N No Yes
19080 3β-Senecioyloxy-6β-hydroxyeremophil-1(10)-ene 3β-Senecioyloxy-6β-hydroxyeremophil-1(10)-ene 3β-Senecioyloxy-6β-hydroxyeremophil-1(10)-ene C20H26O4 330.183 InChIKey=JMPCBBCNNVGUKM-DZXDFRQDSA-N No Yes
19081 3β-Angeloyloxy-6β-hydroxyeremophil-1(10)-en-8β,12-olide 3β-Angeloyloxy-6β-hydroxyeremophil-1(10)-en-8β,12-olide 3β-Angeloyloxy-6β-hydroxyeremophil-1(10)-en-8β,12-olide C20H26O5 346.178 InChIKey=WKZOBKMVDCFETP-NGVPIDNPSA-N No Yes
19082 3β-Angeloyloxy-6β,8α-dihydroxyeremophil-1(10)-en-8β,12-olide 3β-Angeloyloxy-6β,8α-dihydroxyeremophil-1(10)-en-8β,12-olide 3β-Angeloyloxy-6β,8α-dihydroxyeremophil-1(10)-en-8β,12-olide C20H26O6 362.173 InChIKey=VNQVNYIPOUGYKN-LSNGLYKXSA-N No Yes
19083 Roldehrenbergin C Roldehrenbergin C Roldehrenbergin C C21H30O8 410.194 InChIKey=AQPKENNMBQXHGJ-VPFZIOICSA-N No Yes
19084 Roldehrenbergin D Roldehrenbergin D Roldehrenbergin D C22H30O8 422.194 InChIKey=RRNJHEMNHGLOIW-GTWHXRNPSA-N No Yes
19086 Isobutyric acid 2,8-dioxo-3,4abeta,5beta-trimethyl-8aalpha-hydroxy-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta-yl ester Isobutyric acid 2,8-dioxo-3,4abeta,5beta-trimethyl-8aalpha-hydroxy-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta-yl ester Isobutyric acid 2,8-dioxo-3,4abeta,5beta-trimethyl-8aalpha-hydroxy-2,4,4a,5,6,7,8,8a-octahydronaphtho[2,3-b]furan-4beta-yl ester C19H24O6 348.157 InChIKey=GUIUSCZLHIXZMW-GLPXJIDDSA-N No Yes
19087 ligularin A ligularin A ligularin A C30H36O4 460.261 InChIKey=VFPMGMYCGMMUBR-FIFLTTCUSA-N No Yes
19088 ligulolide D ligulolide D ligulolide D C30H38O4 462.277 InChIKey=IMBCDODBZZTARO-YFNDYSSZSA-N No Yes
19089 4beta-(Isobutyryloxy)-8beta,8aalpha-dihydroxy-3,4abeta,5beta-trimethyl-4,4a,5,6,7,8-hexahydronaphtho[2,3-b]furan-9(8aH)-one 4beta-(Isobutyryloxy)-8beta,8aalpha-dihydroxy-3,4abeta,5beta-trimethyl-4,4a,5,6,7,8-hexahydronaphtho[2,3-b]furan-9(8aH)-one 4beta-(Isobutyryloxy)-8beta,8aalpha-dihydroxy-3,4abeta,5beta-trimethyl-4,4a,5,6,7,8-hexahydronaphtho[2,3-b]furan-9(8aH)-one C19H26O6 350.173 InChIKey=PEWPCEZVXROTHG-FBLTZUPUSA-N No Yes
19090 3,5-Dimethyl-6-[(E)-3-pentenyl]benzofuran-7-ol 3,5-Dimethyl-6-[(E)-3-pentenyl]benzofuran-7-ol 3,5-Dimethyl-6-[(E)-3-pentenyl]benzofuran-7-ol C15H18O2 230.131 InChIKey=YUHGYYHCMKCXAZ-SNAWJCMRSA-N No Yes
19091 (5S)-5,6,7,7a,7b,12b-Hexahydro-3,4,5,11,12b-pentamethyl-10-[(3E)-pent-3-en-1-yl]-furo[3’’,2’’: 6’,7’]-naphtho[1’,8’: 4,5,6]pyrano[3,2-b]benzofuran-9-ol (5S)-5,6,7,7a,7b,12b-Hexahydro-3,4,5,11,12b-pentamethyl-10-[(3E)-pent-3-en-1-yl]-furo[3’’,2’’: 6’,7’]-naphtho[1’,8’: 4,5,6]pyrano[3,2-b]benzofuran-9-ol (5S)-5,6,7,7a,7b,12b-Hexahydro-3,4,5,11,12b-pentamethyl-10-[(3E)-pent-3-en-1-yl]-furo[3’’,2’’: 6’,7’]-naphtho[1’,8’: 4,5,6]pyrano[3,2-b]benzofuran-9-ol C30H34O4 458.246 InChIKey=OEYXLQXIEJJIDW-NEEUHDJCSA-N No Yes
19092 2-[[(5S)-9-Hydroxy-3,5-dimethyl-5,6,7,8-tetrahydronaphtho[2,3-b]furan-4-yl]methyl]-3,5-dimethyl-6-[(E)-3-pentenyl]benzofuran-4,7-dione 2-[[(5S)-9-Hydroxy-3,5-dimethyl-5,6,7,8-tetrahydronaphtho[2,3-b]furan-4-yl]methyl]-3,5-dimethyl-6-[(E)-3-pentenyl]benzofuran-4,7-dione 2-[[(5S)-9-Hydroxy-3,5-dimethyl-5,6,7,8-tetrahydronaphtho[2,3-b]furan-4-yl]methyl]-3,5-dimethyl-6-[(E)-3-pentenyl]benzofuran-4,7-dione C30H32O5 472.225 InChIKey=NYALJMJYPVDKLK-LFAOLKIESA-N No Yes
19093 C30H34O4 458.246 InChIKey=WFJDLFQENCZDTJ-MIILPSCYSA-N No Yes
19094 adenostin A adenostin A adenostin A C30H34O4 458.246 InChIKey=YAJPEVBXCVNKQK-GJZGRUSLSA-N No Yes
19095 C30H34O4 458.246 InChIKey=SDUWIOYLRQJRAG-FIFLTTCUSA-N No Yes
19096 3,5-Dimethyl-6-[(E)-3-pentenyl]-4,7-benzofurandione 3,5-Dimethyl-6-[(E)-3-pentenyl]-4,7-benzofurandione 3,5-Dimethyl-6-[(E)-3-pentenyl]-4,7-benzofurandione C15H16O3 244.110 InChIKey=GKCCDKCMOMUYMA-SNAWJCMRSA-N No Yes
19097 Furanoeremophilan-4β,6α-olide Furanoeremophilan-4β,6α-olide Furanoeremophilan-4β,6α-olide C15H18O3 246.126 InChIKey=KTALFCIOJDCGJF-NRWDQBFYSA-N No Yes
19098 8β-Hydroxyeremophil-7(11)-ene-12,8α(4β,6α)-diolide 8β-Hydroxyeremophil-7(11)-ene-12,8α(4β,6α)-diolide 8β-Hydroxyeremophil-7(11)-ene-12,8α(4β,6α)-diolide C15H18O5 278.115 InChIKey=NBDAMGISGFNTQJ-JMAFBPSCSA-N No Yes
19099 8β-Hydroxyeremophil-7(11)-ene-12,8β(4β,6α)-diolide 8β-Hydroxyeremophil-7(11)-ene-12,8β(4β,6α)-diolide 8β-Hydroxyeremophil-7(11)-ene-12,8β(4β,6α)-diolide C15H18O5 278.115 InChIKey=NBDAMGISGFNTQJ-HHYGZGRMSA-N No Yes
19100 8β-Hydroxyl-6β-angloxyeremophil-7(11)-ene-12,8α-olide-15-oic Acid 8β-Hydroxyl-6β-angloxyeremophil-7(11)-ene-12,8α-olide-15-oic Acid 8β-Hydroxyl-6β-angloxyeremophil-7(11)-ene-12,8α-olide-15-oic Acid C20H26O7 378.168 InChIKey=XZBCMOCFJJECSB-TZPNYEDISA-N No Yes
19101 8α-methoxyl-6β-angloxyeremophil-7(11)-ene-12,8β-olide-15-oic Acid 8α-methoxyl-6β-angloxyeremophil-7(11)-ene-12,8β-olide-15-oic Acid 8α-methoxyl-6β-angloxyeremophil-7(11)-ene-12,8β-olide-15-oic Acid C21H28O7 392.184 InChIKey=PLUOSPXAEMKKRW-GVHGUOPMSA-N No Yes
19102 8β-hydroxy-eremophil-3,7 (11)-dien-12,8α(14,6α)-diolide 8β-hydroxy-eremophil-3,7 (11)-dien-12,8α(14,6α)-diolide 8β-hydroxy-eremophil-3,7 (11)-dien-12,8α(14,6α)-diolide C15H16O5 276.100 InChIKey=CNACNPCNCNCMOI-BXLXJPJESA-N No Yes
19103 3α-Hydroxy-11-peroxyl-eremophila-6,9-dien-8-one 3α-Hydroxy-11-peroxyl-eremophila-6,9-dien-8-one 3α-Hydroxy-11-peroxyl-eremophila-6,9-dien-8-one C15H22O4 266.152 InChIKey=NDYANQJXXAKPBS-TURKWSHLSA-N No Yes
19104 Cycloart-23Z-ene-3b,25-diol-3b-trans-ferulate Cycloart-23Z-ene-3b,25-diol-3b-trans-ferulate Cycloart-23Z-ene-3b,25-diol-3b-trans-ferulate C40H58O5 618.428 InChIKey=IQZFGPJVZJWNJS-FWURXDTASA-N No Yes
19105 Tirucalla-7,23-diene-3beta,25-diol Tirucalla-7,23-diene-3beta,25-diol Tirucalla-7,23-diene-3beta,25-diol C30H50O2 442.381 InChIKey=UJGVEQGNNKXYLU-YCWFQQFKSA-N No Yes
19106 2-Methyl-3-decen-2-ol 2-Methyl-3-decen-2-ol 2-Methyl-3-decen-2-ol C11H22O1 170.167 InChIKey=ZPMYAJHMFMUAHT-MDZDMXLPSA-N No Yes
19107 (3Z)-2-methyl-3-decen-2-ol (3Z)-2-methyl-3-decen-2-ol (3Z)-2-methyl-3-decen-2-ol C11H22O1 170.167 InChIKey=ZPMYAJHMFMUAHT-KTKRTIGZSA-N No Yes
19108 (23E)-cycloart-23-ene-3β,25-diol (23E)-cycloart-23-ene-3β,25-diol (23E)-cycloart-23-ene-3β,25-diol C30H50O2 442.381 InChIKey=JSPGKOBNHWTKNT-CPGXJQKCSA-N No Yes
19109 (23E)-cycloart-23-ene-3β,25-diol (23E)-cycloart-23-ene-3β,25-diol (23E)-cycloart-23-ene-3β,25-diol C30H50O2 442.381 InChIKey=JSPGKOBNHWTKNT-CPGXJQKCSA-N No Yes