All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
14417 Massarinin A Massarinin A Massarinin A C21H20O6 368.126 InChIKey=MEPDGCUSJWFRRO-UHFFFAOYSA-N No Yes
14418 Benzoic acid, 4-[[(2S)-2-hydroxy-3-butynyl]oxy]- Benzoic acid, 4-[[(2S)-2-hydroxy-3-butynyl]oxy]- Benzoic acid, 4-[[(2S)-2-hydroxy-3-butynyl]oxy]- C11H10O4 206.058 InChIKey=BHYJLEDUCTYKHX-VIFPVBQESA-N No Yes
14424 3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one 3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one 3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one C14H22O1 206.167 InChIKey=SXPTWBDKLVMRLI-KZWBYHQPSA-N No Yes
14425 9-Thiocyanatopupukeanane 9-Thiocyanatopupukeanane 9-Thiocyanatopupukeanane C16H25N1S1 263.171 InChIKey=DFUFZLNZZBSSFX-RFNFYJRASA-N No Yes
14426 9-epi-9-Thiocyanatopupukeanane 9-epi-9-Thiocyanatopupukeanane 9-epi-9-Thiocyanatopupukeanane C16H25N1S1 263.171 InChIKey=DFUFZLNZZBSSFX-KJSUHCOQSA-N No Yes
14427 Hyrtiosenolide A Hyrtiosenolide A Hyrtiosenolide A C16H22O4 278.152 InChIKey=CSUAKCSONPLSER-HNKHHVNMSA-N No Yes
14428 Hyrtiosenolide B Hyrtiosenolide B Hyrtiosenolide B C16H22O4 278.152 InChIKey=SQWYVTVFJMUPOS-BVUBDWEXSA-N No Yes
14429 Hyrtiosterol Hyrtiosterol Hyrtiosterol C29H48O4 460.355 InChIKey=KGGHMZWSJHYAPD-XBBYEDRRSA-N No Yes
14430 Godotol A Godotol A Godotol A C15H24O2 236.178 InChIKey=FJECUPOJMUFFHN-FKZOYECMSA-N No Yes
14431 Godotol B Godotol B Godotol B C15H24O2 236.178 InChIKey=BQBQOPFBRCPZOA-NELGMTEASA-N No Yes
14432 Hodgsonox B Hodgsonox B Hodgsonox B C15H24O1 220.183 InChIKey=BQYBPRDNNXMGLD-UXOAXIEHSA-N No Yes
14433 Hodgsonox E Hodgsonox E Hodgsonox E C15H22O2 234.162 InChIKey=HMUZLZVXSNTNFV-NDBYEHHHSA-N No Yes
14434 Hodgsonox C Hodgsonox C Hodgsonox C C15H22O3 250.157 InChIKey=ADRDLUFXNZPLNB-OICBVUGWSA-N No Yes
14435 Hodgsonox D Hodgsonox D Hodgsonox D C17H26O4 294.183 InChIKey=LGRRZBIIUKBQSK-MGGIWROYSA-N No Yes
14436 Hodgsonox F Hodgsonox F Hodgsonox F C15H24O3 252.173 InChIKey=QVGKMZGJHTUKAS-RXHHHXIQSA-N No Yes
14437 Hodgsonox G Hodgsonox G Hodgsonox G C15H22O2 234.162 InChIKey=IUUUJUZBSOKEIH-NRWUCQMLSA-N No Yes
14438 Hodgsonox H Hodgsonox H Hodgsonox H C15H22O2 234.162 InChIKey=OINXAOWZYHLIMO-DGTMBMJNSA-N No Yes
14439 LSRLIQNNCDCOJG-SUZMYJTESA- LSRLIQNNCDCOJG-SUZMYJTESA- LSRLIQNNCDCOJG-SUZMYJTESA- C13H20O2 208.146 InChIKey=LSRLIQNNCDCOJG-SUZMYJTESA-N No Yes
14440 LSRLIQNNCDCOJG-CDMKHQONSA- LSRLIQNNCDCOJG-CDMKHQONSA- LSRLIQNNCDCOJG-CDMKHQONSA- C13H20O2 208.146 InChIKey=LSRLIQNNCDCOJG-CDMKHQONSA-N No Yes
14441 XGWAKSLJEAVSMI-NDMJEZRESA- XGWAKSLJEAVSMI-NDMJEZRESA- XGWAKSLJEAVSMI-NDMJEZRESA- C13H20O2 208.146 InChIKey=XGWAKSLJEAVSMI-NDMJEZRESA-N No Yes
14442 (1R,7S,10R)-1-Hydroxy-7-isopropyl-10-methylbicyclo[4.4.0]deca-5-ene-4-one (1R,7S,10R)-1-Hydroxy-7-isopropyl-10-methylbicyclo[4.4.0]deca-5-ene-4-one (1R,7S,10R)-1-Hydroxy-7-isopropyl-10-methylbicyclo[4.4.0]deca-5-ene-4-one C14H22O2 222.162 InChIKey=QSCUHKDLNLVMNB-SCDSUCTJSA-N No Yes
14443 Isoculmorin Isoculmorin Isoculmorin C15H26O2 238.193 InChIKey=GJIFFFJEPUFSMW-SAAWNECCSA-N No Yes
14444 Isoculmorin Isoculmorin Isoculmorin C15H26O2 238.193 InChIKey=GJIFFFJEPUFSMW-SAAWNECCSA-N No Yes
14445 2-(Formylamino)trachyopsane 2-(Formylamino)trachyopsane 2-(Formylamino)trachyopsane C16H27N1O1 249.209 InChIKey=ISXXOZIZRHXJKT-JYPNYAMASA-N No Yes
14446 C24H36N2O1 368.283 InChIKey=SXRJJDBOHDXGCU-DOWKUFCGSA-N No Yes
14447 Tinocordiside Tinocordiside Tinocordiside C21H32O7 396.215 InChIKey=NGDDYINPHJUBKI-IKUYUSIBSA-N No Yes
14451 Epolone B Epolone B Epolone B C24H32O4 384.230 InChIKey=REJAHZFROGUZPE-PMJZKTGZSA-N No Yes
14452 (1S,2R,9S,11S)-2-Hydroxy-9,11-dimethyl-10-methylene-3-oxatricyclo[7.3.1.02,6]tridec-5-en-4-one (1S,2R,9S,11S)-2-Hydroxy-9,11-dimethyl-10-methylene-3-oxatricyclo[7.3.1.02,6]tridec-5-en-4-one (1S,2R,9S,11S)-2-Hydroxy-9,11-dimethyl-10-methylene-3-oxatricyclo[7.3.1.02,6]tridec-5-en-4-one C15H20O3 248.141 InChIKey=SGZIOSXTKWBXTJ-HLHNXRDNSA-N No Yes
14453 Aristoloterpenate-I Aristoloterpenate-I Aristoloterpenate-I C32H31N1O8 557.205 InChIKey=CNCKKGCRDGSHDH-PTDIUHGLSA-N No Yes
14454 Aristoloterpenate-III Aristoloterpenate-III Aristoloterpenate-III C32H31N1O8 557.205 InChIKey=CNCKKGCRDGSHDH-RKTZXBDWSA-N No Yes
14455 Manshurolide Manshurolide Manshurolide C15H20O2 232.146 InChIKey=JOQILOMKLDOWGX-RSPBECQPSA-N No Yes
14456 Patchoulol Patchoulol Patchoulol C15H26O1 222.198 InChIKey=GGHMUJBZYLPWFD-VYDMZQQASA-N No Yes
14457 (5R)-5-Hydroxypatchoulol (5R)-5-Hydroxypatchoulol (5R)-5-Hydroxypatchoulol C15H26O2 238.193 InChIKey=IPUFFAVJUSCNSW-VHOIETNVSA-N No Yes
14458 (7S)-7-Hydroxypatchoulol (7S)-7-Hydroxypatchoulol (7S)-7-Hydroxypatchoulol C15H26O2 238.193 InChIKey=AIMLGXBEYJARFX-OQLCFVJRSA-N No Yes
14459 (8S)-8-Hydroxypatchoulol (8S)-8-Hydroxypatchoulol (8S)-8-Hydroxypatchoulol C15H26O2 238.193 InChIKey=WKGPQOAMUAIBRO-HCTAKKQDSA-N No Yes
14460 (8S)-8-Acetoxypatchoulol (8S)-8-Acetoxypatchoulol (8S)-8-Acetoxypatchoulol C17H28O3 280.204 InChIKey=RAPAFGOPSFDECW-GILVNASBSA-N No Yes
14463 (9R)-9-Hydroxypatchoulol (9R)-9-Hydroxypatchoulol (9R)-9-Hydroxypatchoulol C15H26O2 238.193 InChIKey=FIVPPSZIBGBQNB-JSUQLGMBSA-N No Yes
14464 (9R)-9-Acetoxypatchoulol (9R)-9-Acetoxypatchoulol (9R)-9-Acetoxypatchoulol C17H28O3 280.204 InChIKey=MTRDJBPAIZDSHC-CRMYWFPQSA-N No Yes
14468 Hebelophyllene D Hebelophyllene D Hebelophyllene D C15H24O4 268.167 InChIKey=NQBRRWHYXOYKEQ-JYZMIEGOSA-N No Yes
14469 Hebelophyllene E Hebelophyllene E Hebelophyllene E C15H24O3 252.173 InChIKey=DGHMLXSJSLBSKG-QASSWSFNSA-N No Yes
14470 Hebelophyllene F Hebelophyllene F Hebelophyllene F C16H24O4 280.167 InChIKey=KZIUKKDHFYKXJA-ZOBORPQBSA-N No Yes
14471 Massarinolin A Massarinolin A Massarinolin A C15H18O4 262.121 InChIKey=WSCZAOPWNOYKPC-RCZQDCHWSA-N No Yes
14472 Massarinolin B Massarinolin B Massarinolin B C15H22O4 266.152 InChIKey=GWNSZLIEAQMRLS-SUAOZZTGSA-N No Yes
14473 Massarinolin C Massarinolin C Massarinolin C C15H22O4 266.152 InChIKey=WGXKIUPZJQCFIU-SZDLVHABSA-N No Yes
14474 Heterogorgiolide Heterogorgiolide Heterogorgiolide C16H20O3 260.141 InChIKey=MJZFFAVGHWJTJN-PDGPNTQRSA-N No Yes
14475 (6E)-2r,9r-Epoxyeunicella-6,11(12)-dien-3‚-ol (6E)-2r,9r-Epoxyeunicella-6,11(12)-dien-3‚-ol (6E)-2r,9r-Epoxyeunicella-6,11(12)-dien-3‚-ol C20H32O2 304.240 InChIKey=QFZNULDNHLMPKN-QLVMCECYSA-N No Yes
14479 Longithorol D Longithorol D Longithorol D C22H30O3 342.219 InChIKey=ZHZZOPYJIJGANS-KTQDMNGQSA-N No Yes
14480 Longithorol E Longithorol E Longithorol E C21H26O2 310.193 InChIKey=PHULLDGGFWVHPH-WNVBHWFWSA-N No Yes
14481 9β-(3-Hydroxy-3-methylpentanoyloxy)parthenolide 9β-(3-Hydroxy-3-methylpentanoyloxy)parthenolide 9β-(3-Hydroxy-3-methylpentanoyloxy)parthenolide C21H30O6 378.204 InChIKey=NXPRFOOHJTWPQI-DXWJAGGYSA-N No Yes
14482 9β-(3-Hydroxyisovaleryloxy)parthenolide 9β-(3-Hydroxyisovaleryloxy)parthenolide 9β-(3-Hydroxyisovaleryloxy)parthenolide C20H28O6 364.189 InChIKey=JQVNVUPVYVJHBR-XAEPYKNNSA-N No Yes