All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
6293 Methyl 3a,25-Diacetoxyolean-12-en-28-oate Methyl 3a,25-Diacetoxyolean-12-en-28-oate Methyl 3a,25-Diacetoxyolean-12-en-28-oate C33H52O5 528.381 InChIKey=IANJDXAKJYEGCN-ONONMKDKSA-N No Yes
6295 3alpha,25-Dihydroxyoleana-12-ene-28-oic acid 3alpha,25-Dihydroxyoleana-12-ene-28-oic acid 3alpha,25-Dihydroxyoleana-12-ene-28-oic acid C30H48O4 472.355 InChIKey=ZVNHGZQUXCHNLK-JDBAKTTMSA-N No Yes
6296 Methyl 3a,25-Diacetoxyolean-12-en-28-oate Methyl 3a,25-Diacetoxyolean-12-en-28-oate Methyl 3a,25-Diacetoxyolean-12-en-28-oate C35H54O6 570.392 InChIKey=UGJUYQGLJPJOOO-MRLXXUIVSA-N No Yes
6297 3'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 3'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 3'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin C37H58O9 646.408 InChIKey=GZHUOZHHOSNNHO-JBCPEALYSA-N No Yes
6298 4'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 4'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 4'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin C37H58O9 646.408 InChIKey=OZICUJMVENZDKS-JDEACCKASA-N No Yes
6299 2'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 2'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin 2'-O-Acetyl-3-O-a-L-arabinopyranosyl hederagenin C37H58O9 646.408 InChIKey=ZNHPQEDTLCHPAZ-AACCHRELSA-N No Yes
6300 Oleanolic acid Oleanolic acid Oleanolic acid C30H48O3 456.360 InChIKey=MIJYXULNPSFWEK-GTOFXWBISA-N No Yes
6301 Hederagenin Hederagenin Hederagenin C30H48O4 472.355 InChIKey=PGOYMURMZNDHNS-MYPRUECHSA-N No Yes
6302 12α-epoxy-3β,23-dihydroxyolean-28,13β-olide 12α-epoxy-3β,23-dihydroxyolean-28,13β-olide 12α-epoxy-3β,23-dihydroxyolean-28,13β-olide C30H46O4 470.340 InChIKey=BLPSPKYQVBSTSH-VQMWWCFWSA-N No Yes
6303 Betulinic acid Betulinic acid Betulinic acid C30H48O3 456.360 InChIKey=QGJZLNKBHJESQX-FZFNOLFKSA-N No Yes
6304 3β-Hydroxyolean-12-en-28-al 3β-Hydroxyolean-12-en-28-al 3β-Hydroxyolean-12-en-28-al C30H48O2 440.365 InChIKey=STHRNDDZYFUIDO-OSQDELBUSA-N No Yes
6305 11α,12α-Epoxy-3β, 23-dihydroxy-30-norolean-20(29)-en-28,13β-olide 11α,12α-Epoxy-3β, 23-dihydroxy-30-norolean-20(29)-en-28,13β-olide 11α,12α-Epoxy-3β, 23-dihydroxy-30-norolean-20(29)-en-28,13β-olide C29H42O5 470.303 InChIKey=WYALGIWVJKDMAS-FJHCYMANSA-N No Yes
6308 Spinoside D1 Spinoside D1 Spinoside D1 C48H76O19 956.498 InChIKey=BERQGFHNQROSND-OIGRMBCXSA-N No Yes
6309 Spinoside D2 Spinoside D2 Spinoside D2 C48H74O20 970.477 InChIKey=LSECUOIBYXWBHH-INWUWSBLSA-N No Yes
6310 Spinoside D3 Spinoside D3 Spinoside D3 C48H76O20 972.493 InChIKey=JLPGOJYSBUUDMG-INWUWSBLSA-N No Yes
6311 3-epi-Serratagenic acid 3-epi-Serratagenic acid 3-epi-Serratagenic acid C30H46O5 486.335 InChIKey=MCHKKYSPJGWAHQ-PJEORHSNSA-N No Yes
6312 3β-Hiydroxy-olean-12-ene-28,29-dioic acid 3β-Hiydroxy-olean-12-ene-28,29-dioic acid 3β-Hiydroxy-olean-12-ene-28,29-dioic acid C30H46O5 486.335 InChIKey=MCHKKYSPJGWAHQ-RTZBJCFLSA-N No Yes
6313 ZINC149569217 ZINC149569217 ZINC149569217 C30H48O3 456.360 InChIKey=MIJYXULNPSFWEK-OTFSFDRMSA-N No Yes
6314 3β-Hydroxy-olean-12-ene-28-oic acid 3β-Hydroxy-olean-12-ene-28-oic acid 3β-Hydroxy-olean-12-ene-28-oic acid C30H48O3 456.360 InChIKey=MIJYXULNPSFWEK-KYNNOEDRSA-N No Yes
6315 Spinogenin D3 Spinogenin D3 Spinogenin D3 C30H46O6 502.329 InChIKey=CLXOLTFMHAXJST-PMLGUDCISA-N No Yes
6316 3α-24-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester 3α-24-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester 3α-24-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester C31H50O4 486.371 InChIKey=PLMKQQMDOMTZGG-FIARJCOGSA-N No Yes
6317 3β-23-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester 3β-23-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester 3β-23-dihydroxy-olean-12-ene-28-oic acid Mrthyl ester C31H50O4 486.371 InChIKey=PLMKQQMDOMTZGG-MBZLDFKZSA-N No Yes
6318 3-epi_Hederagenin methyl ester 3-epi_Hederagenin methyl ester 3-epi_Hederagenin methyl ester C31H50O4 486.371 InChIKey=PLMKQQMDOMTZGG-RFUNKSMBSA-N No Yes
6319 3beta-[(2-O-beta-D-Galactopyranosyl-beta-D-glucopyranuronosyl)oxy]-16alpha-hydroxy-23-oxoolean-12-en-28-oic acid 3beta-[(2-O-beta-D-Galactopyranosyl-beta-D-glucopyranuronosyl)oxy]-16alpha-hydroxy-23-oxoolean-12-en-28-oic acid 3beta-[(2-O-beta-D-Galactopyranosyl-beta-D-glucopyranuronosyl)oxy]-16alpha-hydroxy-23-oxoolean-12-en-28-oic acid C42H64O16 824.419 InChIKey=MSSGJMKZJDPGIJ-UHGIRWQDSA-N No Yes
6320 C54H84O24 1116.535 InChIKey=DRNOJFXWLIIKNP-VKTHVNEQSA-N No Yes
6322 3b,25-Epoxy-3a,21a-dihydroxy-22b-tigloyloxyolean-12-ene-28-oic acid 3b,25-Epoxy-3a,21a-dihydroxy-22b-tigloyloxyolean-12-ene-28-oic acid 3b,25-Epoxy-3a,21a-dihydroxy-22b-tigloyloxyolean-12-ene-28-oic acid C35H52O7 584.371 InChIKey=CTQRAHWNNVEBTE-YTGUWKJOSA-N No Yes
6323 Rigidol Rigidol Rigidol C20H34O2 306.256 InChIKey=LSYWVRMBJBFMLJ-RQUXOCDVSA-N No Yes
6324 Kauranoic acid Kauranoic acid Kauranoic acid C20H30O3 318.219 InChIKey=DFXNQVOKZMHGJK-OAAASAAISA-N No Yes
6325 Longirabdolides A Longirabdolides A Longirabdolides A C20H28O6 364.189 InChIKey=MHWZCWHEJWEKPN-MGOAHOADSA-N No Yes
6326 ent-1?-hydroxy-7?-acetyl-15?,16?-epoxykaurane ent-1?-hydroxy-7?-acetyl-15?,16?-epoxykaurane ent-1?-hydroxy-7?-acetyl-15?,16?-epoxykaurane C22H34O4 362.246 InChIKey=DIGOIHGQCOCYOD-ZTIXDYSMSA-N No Yes
6327 ent-Labda-8(20),12Z,14-trien-2alpha-ol ent-Labda-8(20),12Z,14-trien-2alpha-ol ent-Labda-8(20),12Z,14-trien-2alpha-ol C20H32O1 288.245 InChIKey=KIFPWQJEMJLMAS-PRQMMVMVSA-N No Yes
6328 ent-2alpha-Acetoxylabda-8(20),12Z,14-trien-3beta-ol ent-2alpha-Acetoxylabda-8(20),12Z,14-trien-3beta-ol ent-2alpha-Acetoxylabda-8(20),12Z,14-trien-3beta-ol C22H34O3 346.251 InChIKey=NEEBXCYCZYWRJT-KPCHNIOPSA-N No Yes
6329 ent-15β,16β-Epoxykauran-19-oic acid ent-15β,16β-Epoxykauran-19-oic acid ent-15β,16β-Epoxykauran-19-oic acid C20H30O3 318.219 InChIKey=REINKLWVLCQOIC-NOPGUSNKSA-N No Yes
6330 ent-15β,16β-Epoxykauran-19-ol ent-15β,16β-Epoxykauran-19-ol ent-15β,16β-Epoxykauran-19-ol C20H32O2 304.240 InChIKey=YGFBAYGZACDVJQ-HWOCUPQKSA-N No Yes
6331 Methyl ent-12β-Acetoxy-16-kauren-19-oate Methyl ent-12β-Acetoxy-16-kauren-19-oate Methyl ent-12β-Acetoxy-16-kauren-19-oate C23H34O4 374.246 InChIKey=VBXAAPVFPVKVFO-DSHXXCSWSA-N No Yes
6332 Methyl ent-12β-Acetoxy-15-kauren-19-oate Methyl ent-12β-Acetoxy-15-kauren-19-oate Methyl ent-12β-Acetoxy-15-kauren-19-oate C23H34O4 374.246 InChIKey=APKLREKCWOJZOX-DSHXXCSWSA-N No Yes
6333 CHEMBL502677 CHEMBL502677 CHEMBL502677 C22H34O2 330.256 InChIKey=FURHYCBPWRCHKE-AVUJTOBSSA-N No Yes
6334 Methyl ent-15β,16β-Epoxykauran-19-oate Methyl ent-15β,16β-Epoxykauran-19-oate Methyl ent-15β,16β-Epoxykauran-19-oate C21H32O3 332.235 InChIKey=PFHFFBXCOLMJKE-VQQVIHLBSA-N No Yes
6335 ent-8,9-seco-7α,11β-Diacetoxykaura-8(14),16-dien-9,15-dione ent-8,9-seco-7α,11β-Diacetoxykaura-8(14),16-dien-9,15-dione ent-8,9-seco-7α,11β-Diacetoxykaura-8(14),16-dien-9,15-dione C24H32O6 416.220 InChIKey=REDVWPQXGVFYQX-AYQBYMDZSA-N No Yes
6336 ent-8,9-seco-8,14-Epoxy-7α-hydroxy-11β-acetoxy-16-kauren-9,15-dione ent-8,9-seco-8,14-Epoxy-7α-hydroxy-11β-acetoxy-16-kauren-9,15-dione ent-8,9-seco-8,14-Epoxy-7α-hydroxy-11β-acetoxy-16-kauren-9,15-dione C22H30O6 390.204 InChIKey=SGVAXGGRQGLXKO-TUUMUHJWSA-N No Yes
6337 Ludongnin F Ludongnin F Ludongnin F C21H30O5 362.209 InChIKey=YPVJSAYFTDREBJ-YHDMYULQSA-N No Yes
6338 Ludongnin G Ludongnin G Ludongnin G C21H30O5 362.209 InChIKey=YPVJSAYFTDREBJ-KAQOAFHOSA-N No Yes
6339 Ludongnin H Ludongnin H Ludongnin H C21H30O5 362.209 InChIKey=YPVJSAYFTDREBJ-ADEJXDBKSA-N No Yes
6340 Ludongnin I Ludongnin I Ludongnin I C21H30O5 362.209 InChIKey=YPVJSAYFTDREBJ-CQVBDWECSA-N No Yes
6341 Ludongnin J Ludongnin J Ludongnin J C21H28O5 360.194 InChIKey=USNFPPCRYZXOPG-NZMLZKADSA-N No Yes
6342 3-oxo-15β-hydroxy-ent-kaur-16-ene 3-oxo-15β-hydroxy-ent-kaur-16-ene 3-oxo-15β-hydroxy-ent-kaur-16-ene C20H30O2 302.225 InChIKey=QPSIIKWZPZNTQE-NGZXWKFYSA-N No Yes
6343 11β-hydroxy-3,15-dioxo-ent-kaurane 11β-hydroxy-3,15-dioxo-ent-kaurane 11β-hydroxy-3,15-dioxo-ent-kaurane C20H30O3 318.219 InChIKey=MWCHATYQXAABLH-SIFUDWDRSA-N No Yes
6344 7α,11β-dihydroxy-3,15-dioxo-ent-kaurane 7α,11β-dihydroxy-3,15-dioxo-ent-kaurane 7α,11β-dihydroxy-3,15-dioxo-ent-kaurane C20H30O4 334.214 InChIKey=APPAJJQHMXVMPG-YZRDDQQYSA-N No Yes
6345 11β,15β-dihydroxy-3-oxo-ent-kaur-16-ene 11β,15β-dihydroxy-3-oxo-ent-kaur-16-ene 11β,15β-dihydroxy-3-oxo-ent-kaur-16-ene C20H30O3 318.219 InChIKey=ZEYLLKMAEPADQS-SCNMDMPUSA-N No Yes
6346 7β,11β,15β-trihydroxy-3-oxo-ent-kaur-16-ene 7β,11β,15β-trihydroxy-3-oxo-ent-kaur-16-ene 7β,11β,15β-trihydroxy-3-oxo-ent-kaur-16-ene C20H30O4 334.214 InChIKey=UXWGJRDLQQQWKG-QZLQNISESA-N No Yes