All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
13167 (+)-Epievodone (+)-Epievodone (+)-Epievodone C10H12O2 164.084 InChIKey=SMUXTLISYBPIAU-ZCFIWIBFSA-N No Yes
13168 2β-Hidroxy-1,4-Cineole 2β-Hidroxy-1,4-Cineole 2β-Hidroxy-1,4-Cineole C10H18O2 170.131 InChIKey=IFQZADDJTDGGCP-XMCUXHSSSA-N No Yes
13169 p-Menth-1β,4α-Diol p-Menth-1β,4α-Diol p-Menth-1β,4α-Diol C10H20O2 172.146 InChIKey=QCKOHKIBVZRCEQ-MGCOHNPYSA-N No Yes
13170 (+)-Desacetylcalaminthone (+)-Desacetylcalaminthone (+)-Desacetylcalaminthone C10H12O3 180.079 InChIKey=VQJPIDCZXISJKM-CDUCUWFYSA-N No Yes
13171 Paeonilactone B Paeonilactone B Paeonilactone B C10H12O4 196.074 InChIKey=GFSTVWDPRTWASK-QIMWKCOFSA-N No Yes
13172 Paeonilactone A Paeonilactone A Paeonilactone A C10H14O4 198.089 InChIKey=NODZICYHUGDVAM-QXGNCEJQSA-N No Yes
13173 2-Acetoxythymoquinone 2-Acetoxythymoquinone 2-Acetoxythymoquinone C12H14O4 222.089 InChIKey=VGIKIXGNPGVZPT-UHFFFAOYSA-N No Yes
13174 (-)-Calaminthone (-)-Calaminthone (-)-Calaminthone C12H14O4 222.089 InChIKey=LUROOFSVNUUOCG-QTTZVWFDSA-N No Yes
13175 8-Ethoxy-9-Isobutyryloxythymol 8-Ethoxy-9-Isobutyryloxythymol 8-Ethoxy-9-Isobutyryloxythymol C16H24O4 280.167 InChIKey=UZCZRZLPBUFIME-UHFFFAOYSA-N No Yes
13176 (-)-(1R,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) (-)-(1R,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) (-)-(1R,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) C17H24O4 292.167 InChIKey=QXZJAZHTTRQRET-IAGOWNOFSA-N No Yes
13177 (-)-(1S,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) (-)-(1S,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) (-)-(1S,4R)-3-(3'-Furyl)Methyl-1-Hidroxy-2-p-Menthen-1,7-Diol (Acetate) C17H24O4 292.167 InChIKey=QXZJAZHTTRQRET-SJORKVTESA-N No Yes
13178 8,9-Dihydroxy-10-Isobutyryloxy-6-methoxithymol 8,9-Dihydroxy-10-Isobutyryloxy-6-methoxithymol 8,9-Dihydroxy-10-Isobutyryloxy-6-methoxithymol C15H22O6 298.142 InChIKey=NHYWTEOXZLBTEL-UHFFFAOYSA-N No Yes
13179 10-Acetoxy-8,9-Dehydro-6-Methoxy Thymolisobutyrate 10-Acetoxy-8,9-Dehydro-6-Methoxy Thymolisobutyrate 10-Acetoxy-8,9-Dehydro-6-Methoxy Thymolisobutyrate C17H22O5 306.147 InChIKey=DHHGGSJGACOCPQ-UHFFFAOYSA-N No Yes
13180 Paeonilactone C Paeonilactone C Paeonilactone C C17H18O6 318.110 InChIKey=BDKBBWGLLDEQEV-KHOMISBKSA-N No Yes
13182 Schizonepetoside A Schizonepetoside A Schizonepetoside A C16H26O7 330.168 InChIKey=CMULNSPKSRFQAF-VIBAKODTSA-N No Yes
13183 Schizonepetoside C Schizonepetoside C Schizonepetoside C C16H26O7 330.168 InChIKey=WDPNMVOXTFKLMJ-VLQJTGJMSA-N No Yes
13184 α-Pinene α-Pinene α-Pinene C10H16 136.125 InChIKey=GRWFGVWFFZKLTI-UHFFFAOYSA-N No Yes
13185 β-Pinene β-Pinene β-Pinene C10H16 136.125 InChIKey=WTARULDDTDQWMU-UHFFFAOYSA-N No Yes
13186 Chrysanthenone Chrysanthenone Chrysanthenone C10H14O1 150.104 InChIKey=IECBDTGWSQNQID-JGVFFNPUSA-N No Yes
13187 Verbnone Verbnone Verbnone C10H14O1 150.104 InChIKey=DCSCXTJOXBUFGB-UHFFFAOYSA-N No Yes
13188 Cedronellone Cedronellone Cedronellone C20H28O2 300.209 InChIKey=YZHBEINUZQDPPT-AOCUGIFJSA-N No Yes
13189 Camphene Camphene Camphene C10H16 136.125 InChIKey=CRPUJAZIXJMDBK-UHFFFAOYSA-N No Yes
13190 Camphor Camphor Camphor C10H16O1 152.120 InChIKey=DSSYKIVIOFKYAU-GMSGAONNSA-N No Yes
13191 Angelicoidenol Angelicoidenol Angelicoidenol C10H18O2 170.131 InChIKey=HLVIHBJQDKVEAL-QHOPCYEYSA-N No Yes
13192 Shionoside B Shionoside B Shionoside B C22H38O10 462.246 InChIKey=AEOXKDYZLWKANW-SKTRQHGRSA-N No Yes
13193 Shionoside A Shionoside A Shionoside A C21H36O11 464.226 InChIKey=YUKTZNBDFMQAEO-WGQPVWAWSA-N No Yes
13194 3-Carene 3-Carene 3-Carene C10H16 136.125 InChIKey=BQOFWKZOCNGFEC-UHFFFAOYSA-N No Yes
13195 Fenchone Fenchone Fenchone C10H16O1 152.120 InChIKey=LHXDLQBQYFFVNW-UHFFFAOYSA-N No Yes
13196 10-Hydroxyfenchone 10-Hydroxyfenchone 10-Hydroxyfenchone C10H16O2 168.115 InChIKey=HUCDGRHTEUBMQF-FXBDTBDDSA-N No Yes
13197 3-(β-D-Glucopiranosyloxy methyl) -2,4,4-trimethyl-2,5-ciclohexaidien-1-one 3-(β-D-Glucopiranosyloxy methyl) -2,4,4-trimethyl-2,5-ciclohexaidien-1-one 3-(β-D-Glucopiranosyloxy methyl) -2,4,4-trimethyl-2,5-ciclohexaidien-1-one C16H24O7 328.152 InChIKey=AVQPBBJHNZOOAL-UXXRCYHCSA-N No Yes
13198 Jasminoside E Jasminoside E Jasminoside E C16H26O7 330.168 InChIKey=LQZNCRCYYWUMOL-UXXRCYHCSA-N No Yes
13199 Rehmapicroside Rehmapicroside Rehmapicroside C16H26O7 330.168 InChIKey=PTAMKCPERQUKLI-MZHQWRCYSA-N No Yes
13200 d1-Iridomyrmecin d1-Iridomyrmecin d1-Iridomyrmecin C10H16O2 168.115 InChIKey=LYEFRAMOOLOUKA-KKVHJZIVSA-N No Yes
13201 Cistanin Cistanin Cistanin C9H14O4 186.089 InChIKey=JEOPUSJCPYFSMM-CBHQDSPSSA-N No Yes
13202 (1R)-1-Acetoximyodesert-3-ene (1R)-1-Acetoximyodesert-3-ene (1R)-1-Acetoximyodesert-3-ene C12H18O3 210.126 InChIKey=UVHMHLNMYIOYOX-FAQVLOEFSA-N No Yes
13203 (1S)-1-Acetoxymyodesert-3-ene (1S)-1-Acetoxymyodesert-3-ene (1S)-1-Acetoxymyodesert-3-ene C12H18O3 210.126 InChIKey=UVHMHLNMYIOYOX-PUYANOKMSA-N No Yes
13204 α-Gardiol α-Gardiol α-Gardiol C11H14O6 242.079 InChIKey=QEGAWOPOQXLXMR-UCLAKJBNSA-N No Yes
13205 β-Gardiol β-Gardiol β-Gardiol C11H14O6 242.079 InChIKey=QEGAWOPOQXLXMR-NERBKRFESA-N No Yes
13206 Allamandicin Allamandicin Allamandicin C15H16O7 308.090 InChIKey=RMYLCIMGXGYTTK-OWTCTZJSSA-N No Yes
13207 Isoallamandicin Isoallamandicin Isoallamandicin C15H16O7 308.090 InChIKey=RMYLCIMGXGYTTK-MIBNAEDWSA-N No Yes
13208 Allamancin Allamancin Allamancin C15H18O8 326.100 InChIKey=VLBNONAQDKTJCU-KGEWMJHGSA-N No Yes
13209 2(E),4-Ochtodien-1,6(R*)-diol 2(E),4-Ochtodien-1,6(R*)-diol 2(E),4-Ochtodien-1,6(R*)-diol C10H16O2 168.115 InChIKey=OZMPRKSGMPJXGO-RDOCRHDPSA-N No Yes
13210 2(Z),4-Ochtodien-1,6(R*)-diol 2(Z),4-Ochtodien-1,6(R*)-diol 2(Z),4-Ochtodien-1,6(R*)-diol C10H16O2 168.115 InChIKey=OZMPRKSGMPJXGO-QRJSTWQJSA-N No Yes
13211 1,3(8)-Ochtodiene-5,6-diol 1,3(8)-Ochtodiene-5,6-diol 1,3(8)-Ochtodiene-5,6-diol C10H16O2 168.115 InChIKey=LGRVNVACYBVGTJ-UHFFFAOYSA-N No Yes
13212 1,3(8)-Ochtodien-5,6(S*)-diol 1,3(8)-Ochtodien-5,6(S*)-diol 1,3(8)-Ochtodien-5,6(S*)-diol C10H16O2 168.115 InChIKey=LGRVNVACYBVGTJ-YGPZHTELSA-N No Yes
13213 1,3(8)-Ochtodien-3,6(R*)-diol 1,3(8)-Ochtodien-3,6(R*)-diol 1,3(8)-Ochtodien-3,6(R*)-diol C10H16O2 168.115 InChIKey=QADDRLOXVSSUEX-HNHGDDPOSA-N No Yes
13226 16a-Hydroxymollic acid 16a-Hydroxymollic acid 16a-Hydroxymollic acid C30H48O5 488.350 InChIKey=VWNUHNZMJZXAEG-NDOZDWOASA-N No Yes
13227 15a-Hydroxymollic acid 15a-Hydroxymollic acid 15a-Hydroxymollic acid C30H48O5 488.350 InChIKey=YNRJWLCUSNZCQL-QROLTNJXSA-N No Yes
13228 7b,16b-Dihydroxy-1,23-dideoxyjessic acid 7b,16b-Dihydroxy-1,23-dideoxyjessic acid 7b,16b-Dihydroxy-1,23-dideoxyjessic acid C31H50O5 502.366 InChIKey=NMGCAUZQKXGUAO-OVPHTCQKSA-N No Yes
13229 (24S)-Cycloart-25-ene-3b,24-diol-3b-trans-ferulate (24S)-Cycloart-25-ene-3b,24-diol-3b-trans-ferulate (24S)-Cycloart-25-ene-3b,24-diol-3b-trans-ferulate C40H58O5 618.428 InChIKey=DIFORLMUHJRMIX-MVEUAYAHSA-N No Yes