All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
18003 ( )-(5S,6S,10S)-iso-β-elemene ( )-(5S,6S,10S)-iso-β-elemene ( )-(5S,6S,10S)-iso-β-elemene C15H24 204.188 InChIKey=GJWVPRIGTFVAQW-RBSFLKMASA-N No Yes
18004 Iso-α-humulene Iso-α-humulene Iso-α-humulene C15H24 204.188 InChIKey=RTIZXJCGCGLKCH-GXMLAKGOSA-N No Yes
18005 (+)-(5R,6S,10S)-α-gorgonene (+)-(5R,6S,10S)-α-gorgonene (+)-(5R,6S,10S)-α-gorgonene C15H24 204.188 InChIKey=OLYGAQAHPBFDGU-RBSFLKMASA-N No Yes
18006 (5S,6S,10S)-Gorgona-1,4(15),11-triene (5S,6S,10S)-Gorgona-1,4(15),11-triene (5S,6S,10S)-Gorgona-1,4(15),11-triene C15H22 202.172 InChIKey=KSQRZYSCIBVHIW-RBSFLKMASA-N No Yes
18007 Gorgon-11-en-4-ol Gorgon-11-en-4-ol Gorgon-11-en-4-ol C15H26O1 222.198 InChIKey=GWQUKIFNLZSKBV-APIJFGDWSA-N No Yes
18008 Aromadendra-4(15),10(14)-dien-1-ol Aromadendra-4(15),10(14)-dien-1-ol Aromadendra-4(15),10(14)-dien-1-ol C15H22 202.172 InChIKey=JNXBLAGJPYZBMG-XUXIUFHCSA-N No Yes
18009 (+)-(1R*,4S*,5S*,7S*,10S*)-Viticulol (+)-(1R*,4S*,5S*,7S*,10S*)-Viticulol (+)-(1R*,4S*,5S*,7S*,10S*)-Viticulol C20H34O1 290.261 InChIKey=DOGQNYXCCXBVMX-WKWVNEEDSA-N No Yes
18010 7,7-Dimethyl-2-methylenebicyclo[3.1.1]heptane-6-ol acetate 7,7-Dimethyl-2-methylenebicyclo[3.1.1]heptane-6-ol acetate 7,7-Dimethyl-2-methylenebicyclo[3.1.1]heptane-6-ol acetate C12H18O2 194.131 InChIKey=NSUMZFLFAJHUFQ-UHFFFAOYSA-N No Yes
18011 6,6,8,9-tetramethyltricyclo[3.3.3.0]undec-7-en-2-ol 6,6,8,9-tetramethyltricyclo[3.3.3.0]undec-7-en-2-ol 6,6,8,9-tetramethyltricyclo[3.3.3.0]undec-7-en-2-ol C15H24O1 220.183 InChIKey=JAELKEBODQWGTA-ZRZIZSTPSA-N No Yes
18012 Fascicularone A Fascicularone A Fascicularone A C14H20O4 252.136 InChIKey=PIWPHUKZKLFPOJ-AHPXUNCLSA-N No Yes
18013 Fascicularone B Fascicularone B Fascicularone B C15H22O4 266.152 InChIKey=JHJQFYPUGZHONZ-PCHBDJRGSA-N No Yes
18014 4-Epi-11-nor-aristola-1(10),11-diene 4-Epi-11-nor-aristola-1(10),11-diene 4-Epi-11-nor-aristola-1(10),11-diene C14H20 188.157 InChIKey=DDBCGKCAUYNHJO-WBMYTEFPSA-N No Yes
18015 4-Epi-11-nor-aristola-1,9,11-triene 4-Epi-11-nor-aristola-1,9,11-triene 4-Epi-11-nor-aristola-1,9,11-triene C14H18 186.141 InChIKey=SAIRXKYZNUJSKG-WBMYTEFPSA-N No Yes
18016 (-)-Aristol-1(10)-en-12-ol (-)-Aristol-1(10)-en-12-ol (-)-Aristol-1(10)-en-12-ol C15H24O1 220.183 InChIKey=DAUNXXZYAHCLLW-RTBZAZRGSA-N No Yes
18017 (-)-Aristol-1(10)-en-12-al (-)-Aristol-1(10)-en-12-al (-)-Aristol-1(10)-en-12-al C15H22O1 218.167 InChIKey=IQBWPZYQOFAABM-RTBZAZRGSA-N No Yes
18018 Pregeijerene B Pregeijerene B Pregeijerene B C12H18 162.141 InChIKey=HJFJPKDXNZHKGG-LFVGHESCSA-N No Yes
18019 6-Epi-α-Cubebene 6-Epi-α-Cubebene 6-Epi-α-Cubebene C15H24 204.188 InChIKey=XUEHVOLRMXNRKQ-YKYMWBLQSA-N No Yes
18020 6-Epi-β-Cubebene 6-Epi-β-Cubebene 6-Epi-β-Cubebene C15H24 204.188 InChIKey=FSRZGYRCMPZNJF-CAEXGNQWSA-N No Yes
18021 6-Epi-Cubenol 6-Epi-Cubenol 6-Epi-Cubenol C15H26O1 222.198 InChIKey=COGPRPSWSKLKTF-LXTVHRRPSA-N No Yes
18022 (-)-Petasitene (-)-Petasitene (-)-Petasitene C15H24 204.188 InChIKey=ZGKPBXWQOYDEMA-CTHBEMJXSA-N No Yes
18023 (+)-(3R)-Petasitenepoxide (+)-(3R)-Petasitenepoxide (+)-(3R)-Petasitenepoxide C15H24O1 220.183 InChIKey=QQEQJPYRRHIGJN-DEPYFDJDSA-N No Yes
18024 (-)-Albene (-)-Albene (-)-Albene C12H18 162.141 InChIKey=HKLBEHRJWPWLOB-QCNOEVLYSA-N No Yes
18025 (-)-Albenone (-)-Albenone (-)-Albenone C12H16O1 176.120 InChIKey=MBRPPNCMKAGHNL-LUTQBAROSA-N No Yes
18026 (-)-Albanone (-)-Albanone (-)-Albanone C12H18O1 178.136 InChIKey=XONOBMQASQEADR-LUTQBAROSA-N No Yes
18027 (+)-(3S)-Petasitan-3-ol (+)-(3S)-Petasitan-3-ol (+)-(3S)-Petasitan-3-ol C15H26O1 222.198 InChIKey=WKIFBLKRQAKNME-QRTUWBSPSA-N No Yes
18028 (-)-Pethybrene (-)-Pethybrene (-)-Pethybrene C15H24 204.188 InChIKey=BPSJFUIWVOWJNO-LKWLHFCZSA-N No Yes
18029 (-)-Trifara-9,4-diene (-)-Trifara-9,4-diene (-)-Trifara-9,4-diene C15H24 204.188 InChIKey=UYQNCGFXZZVAAK-JKRDAVGYSA-N No Yes
18030 (-)-3,7-Di-epi-trifara-9,14-diene (-)-3,7-Di-epi-trifara-9,14-diene (-)-3,7-Di-epi-trifara-9,14-diene C15H24 204.188 InChIKey=UYQNCGFXZZVAAK-OXUNJRBLSA-N No Yes
18031 (+)-Sandvicene (+)-Sandvicene (+)-Sandvicene C15H24 204.188 InChIKey=XFFSZJFAUMNTMB-UKRRQHHQSA-N No Yes
18032 (+)-Neotrifaradiene (+)-Neotrifaradiene (+)-Neotrifaradiene C15H24 204.188 InChIKey=WWXVUFOHSHXMKJ-DHMWGJHJSA-N No Yes
18033 1,13-Dihydroxyherbertene 1,13-Dihydroxyherbertene 1,13-Dihydroxyherbertene C15H22O2 234.162 InChIKey=RWRCROWOIGNRGD-HNNXBMFYSA-N No Yes
18034 12-Methoxyherbertene-1,2-diol 12-Methoxyherbertene-1,2-diol 12-Methoxyherbertene-1,2-diol C16H24O3 264.173 InChIKey=WBWSSBOUYGDHAI-MRXNPFEDSA-N No Yes
18035 Herbertenone A Herbertenone A Herbertenone A C15H22O2 234.162 InChIKey=IAHVMQAYDBMMQB-LSDHHAIUSA-N No Yes
18036 (+)-10β(H)-Muurola-3,7(11)-dien-1-ol (+)-10β(H)-Muurola-3,7(11)-dien-1-ol (+)-10β(H)-Muurola-3,7(11)-dien-1-ol C15H24O1 220.183 InChIKey=VXQLDLRZLVFYFR-BPLDGKMQSA-N No Yes
18037 (-)-α-Alasken-6β-ol (-)-α-Alasken-6β-ol (-)-α-Alasken-6β-ol C15H24O1 220.183 InChIKey=XDDWKHKVKLJESI-BPLDGKMQSA-N No Yes
18038 (-)-α-Alaskene (-)-α-Alaskene (-)-α-Alaskene C15H24 204.188 InChIKey=HMKLOOMRRZKSNM-UKRRQHHQSA-N No Yes
18039 (-)-α-Alasken-8-one (-)-α-Alasken-8-one (-)-α-Alasken-8-one C15H22O1 218.167 InChIKey=ZZDZYXINURVBJN-IUODEOHRSA-N No Yes
18040 (-)-α-Alasken-8-one (-)-α-Alasken-8-one (-)-α-Alasken-8-one C15H22O1 218.167 InChIKey=ZZDZYXINURVBJN-IUODEOHRSA-N No Yes
18041 9α-Hydroxy-2β-methoxyclovane 9α-Hydroxy-2β-methoxyclovane 9α-Hydroxy-2β-methoxyclovane C16H28O2 252.209 InChIKey=CINURJJDMOKVMD-AKIOZOGOSA-N No Yes
18042 6β,9α-Dihydroxy-2β-methoxyclovane 6β,9α-Dihydroxy-2β-methoxyclovane 6β,9α-Dihydroxy-2β-methoxyclovane C16H28O3 268.204 InChIKey=YQOHCYMWPXAQTM-WFZWMLOVSA-N No Yes
18043 CHEMBL2227788 CHEMBL2227788 CHEMBL2227788 C16H26O2 250.193 InChIKey=OPOZLLBXDVIYTB-MZGVZZPPSA-N No Yes
18044 9β-Hydroxy-2β-methoxyclovane 9β-Hydroxy-2β-methoxyclovane 9β-Hydroxy-2β-methoxyclovane C16H28O2 252.209 InChIKey=CINURJJDMOKVMD-IICXDKKESA-N No Yes
18045 6α,9β-Dihydroxy-2β-methoxyclovane 6α,9β-Dihydroxy-2β-methoxyclovane 6α,9β-Dihydroxy-2β-methoxyclovane C16H28O3 268.204 InChIKey=YQOHCYMWPXAQTM-JMACTJGESA-N No Yes
18046 2β,9β-Dihydroxyclovane 2β,9β-Dihydroxyclovane 2β,9β-Dihydroxyclovane C15H26O2 238.193 InChIKey=BWXJQHJHGMZLBT-YLXLXVFQSA-N No Yes
18047 6β,9β-Dihydroxy-2b-methoxyclovane 6β,9β-Dihydroxy-2b-methoxyclovane 6β,9β-Dihydroxy-2b-methoxyclovane C16H28O3 268.204 InChIKey=YQOHCYMWPXAQTM-JKPJVAMOSA-N No Yes
18048 2β,6β,9β-Trihydroxyclovane 2β,6β,9β-Trihydroxyclovane 2β,6β,9β-Trihydroxyclovane C15H26O3 254.188 InChIKey=UVLCTHMOJINEAS-KPRRGPHJSA-N No Yes
18049 Brasila-5,10-diene Brasila-5,10-diene Brasila-5,10-diene C15H24 204.188 InChIKey=KUBSAWBFAOYMLQ-SMDDNHRTSA-N No Yes
18050 Presilphiperfolan-1-ol Presilphiperfolan-1-ol Presilphiperfolan-1-ol C15H26O1 222.198 InChIKey=ABEFZRUFMKMACI-FPVZYODXSA-N No Yes
18051 3,3abeta,4,5,6,7-Hexahydro-1,4beta,7alpha,8-tetramethyl-2H-cyclopentacyclooctene-2-one 3,3abeta,4,5,6,7-Hexahydro-1,4beta,7alpha,8-tetramethyl-2H-cyclopentacyclooctene-2-one 3,3abeta,4,5,6,7-Hexahydro-1,4beta,7alpha,8-tetramethyl-2H-cyclopentacyclooctene-2-one C15H22O1 218.167 InChIKey=CQXXASZOSSOFRW-ZRAGYQRKSA-N No Yes
18052 C15H22O2 234.162 InChIKey=DAHTUHNTQCWSPH-NYWQGFLHSA-N No Yes