All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
3601 3-O-(E)-Coumaroyl-b-amyrin 3-O-(E)-Coumaroyl-b-amyrin 3-O-(E)-Coumaroyl-b-amyrin C39H56O3 572.423 InChIKey=FFDJUOCBIYIQHJ-JWULUACBSA-N No Yes
3602 3-O-(Z)-Coumaroyl-b-amyrin 3-O-(Z)-Coumaroyl-b-amyrin 3-O-(Z)-Coumaroyl-b-amyrin C39H56O3 572.423 InChIKey=FFDJUOCBIYIQHJ-ZBNMYHHLSA-N No Yes
3603 3-O-Dihydrocoumaroyl-b-amyrin 3-O-Dihydrocoumaroyl-b-amyrin 3-O-Dihydrocoumaroyl-b-amyrin C39H58O3 574.439 InChIKey=XIVVFNWOZPZEIW-SSYQYTRCSA-N No Yes
3604 3-O-(E)-Coumaroyl erythrodiol 3-O-(E)-Coumaroyl erythrodiol 3-O-(E)-Coumaroyl erythrodiol C39H56O4 588.418 InChIKey=JIHRTYNJAACOFO-DMJWQGLTSA-N No Yes
3605 3-O-(Z)-Coumaroyl erythrodiol 3-O-(Z)-Coumaroyl erythrodiol 3-O-(Z)-Coumaroyl erythrodiol C39H56O4 588.418 InChIKey=JIHRTYNJAACOFO-ATKIIQCASA-N No Yes
3606 3-O-(Z)-Coumaroyl oleanolic acid 3-O-(Z)-Coumaroyl oleanolic acid 3-O-(Z)-Coumaroyl oleanolic acid C39H54O5 602.397 InChIKey=PSKOYUFGDWKJBO-CEDKKCENSA-N No Yes
3607 3-O-(E)-Coumaroyl oleanolic acid 3-O-(E)-Coumaroyl oleanolic acid 3-O-(E)-Coumaroyl oleanolic acid C30H50O2 442.381 InChIKey=PSZDOEIIIJFCFE-OSQDELBUSA-N No Yes
3608 oleanolic acid oleanolic acid oleanolic acid C30H48O3 456.360 InChIKey=MIJYXULNPSFWEK-GTOFXWBISA-N No Yes
3609 δ_Amyrone δ_Amyrone δ_Amyrone C30H48O1 424.371 InChIKey=KPUDOJPVQQJLGI-CKARLABJSA-N No Yes
3610 3-Epi-δ-amyrin 3-Epi-δ-amyrin 3-Epi-δ-amyrin C30H50O1 426.386 InChIKey=JOCIRBSYAYKMEF-HJNBUTKPSA-N No Yes
3611 δ-Amyrin δ-Amyrin δ-Amyrin C30H50O1 426.386 InChIKey=JOCIRBSYAYKMEF-YDPPSCFKSA-N No Yes
3612 Sarmentolin Sarmentolin Sarmentolin C30H48O3 456.360 InChIKey=WBPQDZLDWHMOAG-MLTBFBPQSA-N No Yes
3613 3-Oxo-22beta-hydroxyurs-12-ene-30-oic acid 3-Oxo-22beta-hydroxyurs-12-ene-30-oic acid 3-Oxo-22beta-hydroxyurs-12-ene-30-oic acid C30H46O4 470.340 InChIKey=QGMNTKNSMLYTKS-ICBHFZINSA-N No Yes
3614 3-Oxo-28-hydroxyurs-12-ene-30-oic acid 3-Oxo-28-hydroxyurs-12-ene-30-oic acid 3-Oxo-28-hydroxyurs-12-ene-30-oic acid C30H46O4 470.340 InChIKey=KDBHZDDUZGESHE-UKDOZMRVSA-N No Yes
3615 2a,3b-Dihydroxy-olean-12-ene-22,29-lactone 2a,3b-Dihydroxy-olean-12-ene-22,29-lactone 2a,3b-Dihydroxy-olean-12-ene-22,29-lactone C30H46O4 470.340 InChIKey=RMZYLHSFNGKWCT-XBKDIJSYSA-N No Yes
3616 3-Oxo-28-hydroxyoleana-12-ene-29-oic acid 3-Oxo-28-hydroxyoleana-12-ene-29-oic acid 3-Oxo-28-hydroxyoleana-12-ene-29-oic acid C30H46O4 470.340 InChIKey=HVLPFRAXQYBRJO-SIBVWYKESA-N No Yes
3617 3beta,28-Dihydroxyoleana-12-ene-29-oic acid 3beta,28-Dihydroxyoleana-12-ene-29-oic acid 3beta,28-Dihydroxyoleana-12-ene-29-oic acid C30H48O4 472.355 InChIKey=DDJYMOPTHNUMHK-GNSVDKAYSA-N No Yes
3618 3alpha,28-Dihydroxyoleana-12-ene-29-oic acid 3alpha,28-Dihydroxyoleana-12-ene-29-oic acid 3alpha,28-Dihydroxyoleana-12-ene-29-oic acid C30H48O4 472.355 InChIKey=DDJYMOPTHNUMHK-QZNVJFJLSA-N No Yes
3619 2b.22b-Dihidroxy-3,21-dioxo-24-carboxyl-29-nor-friedelan methyl ester 2b.22b-Dihidroxy-3,21-dioxo-24-carboxyl-29-nor-friedelan methyl ester 2b.22b-Dihidroxy-3,21-dioxo-24-carboxyl-29-nor-friedelan methyl ester C30H46O6 502.329 InChIKey=MSVQOBXUOCLVIA-QPCRJFSFSA-N No Yes
3620 21b,28b-Dihydroxy-3-oxo-olean-12,20(30)-diene 21b,28b-Dihydroxy-3-oxo-olean-12,20(30)-diene 21b,28b-Dihydroxy-3-oxo-olean-12,20(30)-diene C29H44O3 440.329 InChIKey=TZAFFNGIGHHXRX-XPKJKFCLSA-N No Yes
3621 2,22beta-Dihydroxy-3-oxooleana-1,12-diene-29-oic acid 2,22beta-Dihydroxy-3-oxooleana-1,12-diene-29-oic acid 2,22beta-Dihydroxy-3-oxooleana-1,12-diene-29-oic acid C30H44O5 484.319 InChIKey=QKILFMSWLLPBID-MFWVMLLYSA-N No Yes
3622 2,3-Dihydroxy-6beta-(1-hydroxyethyl)-24-nor-D:A-friedooleanane-1,3,5(10),7-tetrene-29-oic acid 2,3-Dihydroxy-6beta-(1-hydroxyethyl)-24-nor-D:A-friedooleanane-1,3,5(10),7-tetrene-29-oic acid 2,3-Dihydroxy-6beta-(1-hydroxyethyl)-24-nor-D:A-friedooleanane-1,3,5(10),7-tetrene-29-oic acid C31H44O5 496.319 InChIKey=UZTWKCSXTUDYPH-CPNBMZKQSA-N No Yes
3623 Triptotin F Triptotin F Triptotin F C31H44O5 496.319 InChIKey=UZTWKCSXTUDYPH-POEAZOMSSA-N No Yes
3624 2,3-seco-22.29-Lactone-oleane-12-ene-2,3-dioic acid 3-methyl ester 2,3-seco-22.29-Lactone-oleane-12-ene-2,3-dioic acid 3-methyl ester 2,3-seco-22.29-Lactone-oleane-12-ene-2,3-dioic acid 3-methyl ester C31H46O6 514.329 InChIKey=QZBDEVOGZSLFDG-XGDWWMEPSA-N No Yes
3625 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
3626 C41H64O16 812.419 InChIKey=BLAOWYPSWHVHOA-DUPQUQFFSA-N No Yes
3627 Segetalic acid Segetalic acid Segetalic acid C29H46O5 474.335 InChIKey=RKXJRRJVPGLACY-RZPFCHDPSA-N No Yes
3628 3-Keto,16a-hydroxy,24-noroleanolic acid 3-Keto,16a-hydroxy,24-noroleanolic acid 3-Keto,16a-hydroxy,24-noroleanolic acid C29H44O4 456.324 InChIKey=RVBCCBBWGJZXNN-XZCVLLCJSA-N No Yes
3629 23-Galloylarjunolic acid 23-Galloylarjunolic acid 23-Galloylarjunolic acid C37H52O9 640.361 InChIKey=LXTNFTYLTNCGNG-RWZVSUPFSA-N No Yes
3630 28-O-b-D-glucopyramosyl ester 28-O-b-D-glucopyramosyl ester 28-O-b-D-glucopyramosyl ester C43H62O14 802.414 InChIKey=JJZYSZZGDXLURN-IVHXVSHPSA-N No Yes
3631 1-Oxoerythrodiol 1-Oxoerythrodiol 1-Oxoerythrodiol C30H48O3 456.360 InChIKey=BXVZONSMHFNFBE-GPAJXWGPSA-N No Yes
3632 11-Oxoerythrodiol 11-Oxoerythrodiol 11-Oxoerythrodiol C30H48O3 456.360 InChIKey=VQWZLGYZILZLOV-IPUKRSQLSA-N No Yes
3633 Castanopsone Castanopsone Castanopsone C30H48O2 440.365 InChIKey=LZPGYZAPTONPJS-YEGDJMBSSA-N No Yes
3634 13,28-epoxy-11-oleanene-3-one 13,28-epoxy-11-oleanene-3-one 13,28-epoxy-11-oleanene-3-one C30H46O2 438.350 InChIKey=BFSRJRKZZSIEFP-LOXDOLLQSA-N No Yes
3635 28-O-α-L-rhamnopyranosyl(1--> 4)-β-D-glucopyranosyl(1--> 6)-β-D-glucopyranosyl esters of 3 α,29-dihydroxy-olean-12-en-28-oic acid 28-O-α-L-rhamnopyranosyl(1--> 4)-β-D-glucopyranosyl(1--> 6)-β-D-glucopyranosyl esters of 3 α,29-dihydroxy-olean-12-en-28-oic acid 28-O-α-L-rhamnopyranosyl(1--> 4)-β-D-glucopyranosyl(1--> 6)-β-D-glucopyranosyl esters of 3 α,29-dihydroxy-olean-12-en-28-oic acid C48H78O18 942.519 InChIKey=QMIBWALTTZKWNN-OMAXGHDUSA-N No Yes
3636 Spinoside C2 Spinoside C2 Spinoside C2 C48H76O19 956.498 InChIKey=IFYHLPBBPBCPBM-LVRKUJMWSA-N No Yes
3637 Spinoside C3 Spinoside C3 Spinoside C3 C47H76O18 928.503 InChIKey=RBJPMVQLSUUBKB-IHRXQSPXSA-N No Yes
3638 Spinoside C4 Spinoside C4 Spinoside C4 C48H78O19 958.514 InChIKey=RQRYZGLUHFCIEV-YUZTZWDESA-N No Yes
3639 Spinoside C5 Spinoside C5 Spinoside C5 C48H76O19 956.498 InChIKey=IFYHLPBBPBCPBM-YUZTZWDESA-N No Yes
3640 Spinoside C6 Spinoside C6 Spinoside C6 C47H76O19 944.498 InChIKey=LZTJOTPKQYCXHR-VPBDZAIUSA-N No Yes
3641 Spinoside C7 Spinoside C7 Spinoside C7 C47H74O19 942.482 InChIKey=GKHRBOAUARGULE-VPBDZAIUSA-N No Yes
3642 Spinogenin C2 Spinogenin C2 Spinogenin C2 C30H46O5 486.335 InChIKey=KGXZYNGIOXTPCP-CJXDQPBKSA-N No Yes
3643 Spinogenin C2 monoglucosyl ester Spinogenin C2 monoglucosyl ester Spinogenin C2 monoglucosyl ester C36H56O10 648.387 InChIKey=RQUPISPZJQVAAL-MJNUIVECSA-N No Yes
3644 Spinoside C3 Spinoside C3 Spinoside C3 C29H46O4 458.340 InChIKey=OLTNYMHTOUJXPV-FOOUEXEYSA-N No Yes
3645 Spinogenin C3 monoglucosyl ester Spinogenin C3 monoglucosyl ester Spinogenin C3 monoglucosyl ester C35H56O9 620.392 InChIKey=SFVRXKFOXANJSU-CRNCOTHESA-N No Yes
3646 Spinogenin C6 Spinogenin C6 Spinogenin C6 C29H46O5 474.335 InChIKey=ONLSRBVFGVMWOK-PGYIHPJDSA-N No Yes
3647 erythrodiol-3-caffeate erythrodiol-3-caffeate erythrodiol-3-caffeate C39H56O5 604.413 InChIKey=NPRKWCDSDHHADP-LNLIXLHGSA-N No Yes
3648 C39H54O6 618.392 InChIKey=OJEUMHQEAMVIBI-YWDNYDSNSA-N No Yes
3649 (3β,18α)-3-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-23-hydroxyolean-12-en-28-oic acid (3β,18α)-3-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-23-hydroxyolean-12-en-28-oic acid (3β,18α)-3-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-23-hydroxyolean-12-en-28-oic acid C39H54O7 634.387 InChIKey=DYNMMAFSXUQKOH-QPLVNVOKSA-N No Yes
3650 (3β,18α)-23-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-3-hydroxyolean-12-en-28-oic acid (3β,18α)-23-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-3-hydroxyolean-12-en-28-oic acid (3β,18α)-23-{[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]oxy}-3-hydroxyolean-12-en-28-oic acid C39H54O7 634.387 InChIKey=CGUVDUJUXIATLL-QPLVNVOKSA-N No Yes