All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
3542 7 a-Hydroxyisoxuxuarine E a 7 a-Hydroxyisoxuxuarine E a 7 a-Hydroxyisoxuxuarine E a C60H80O10 960.575 InChIKey=FAFYROQRWPIQPP-RHVYPIBJSA-N No Yes
3543 7 ,8 -Dihydroxuxuarine A a 7 ,8 -Dihydroxuxuarine A a 7 ,8 -Dihydroxuxuarine A a C56H72O7 856.528 InChIKey=FRSVTVPTKAPUES-WMMWNHQSSA-N No Yes
3544 7 ,8 -Dihydroxuxuarine D b 7 ,8 -Dihydroxuxuarine D b 7 ,8 -Dihydroxuxuarine D b C56H72O8 872.523 InChIKey=LPLKITYJSHNVOP-YSXYYOLLSA-N No Yes
3545 Xuxuarine Ha Xuxuarine Ha Xuxuarine Ha C58H74O9 914.533 InChIKey=BXGVISXOHDTJCM-IXXIWKKMSA-N No Yes
3546 Xuxuarine Hb Xuxuarine Hb Xuxuarine Hb C58H74O9 914.533 InChIKey=BXGVISXOHDTJCM-IANNRXGXSA-N No Yes
3547 Xuxuarine I a Xuxuarine I a Xuxuarine I a C58H74O9 914.533 InChIKey=DCOXHYBPGSQNLA-QVKCREGFSA-N No Yes
3548 Xuxuarine Ib Xuxuarine Ib Xuxuarine Ib C58H74O9 914.533 InChIKey=DCOXHYBPGSQNLA-OBVKGYOXSA-N No Yes
3549 Isoxuxuarine Ha Isoxuxuarine Ha Isoxuxuarine Ha C58H74O9 914.533 InChIKey=KPCDPJXEQMAVHP-IXXIWKKMSA-N No Yes
3550 7,8-Dihydroisoxuxuarine H a 7,8-Dihydroisoxuxuarine H a 7,8-Dihydroisoxuxuarine H a C58H76O9 916.549 InChIKey=LXYGLSNKFFTXQA-MGGBFIIHSA-N No Yes
3551 7,8-Dihydroisoxuxuarine Ia 7,8-Dihydroisoxuxuarine Ia 7,8-Dihydroisoxuxuarine Ia C58H76O9 916.549 InChIKey=CXTCAPCFZXTNBN-RJMKERDESA-N No Yes
3552 Xuxuarine Ja Xuxuarine Ja Xuxuarine Ja C58H76O9 916.549 InChIKey=QUFBOMYRXOMFMX-GMTKWLJASA-N No Yes
3554 Paeonenoide A Paeonenoide A Paeonenoide A C28H40O6 472.282 InChIKey=QUSTXILFWOVTCK-WEEWHIELSA-N No Yes
3555 Paeonenoide B Paeonenoide B Paeonenoide B C28H40O3 424.298 InChIKey=PFOJFEVLTKXQKE-LEUZZWHASA-N No Yes
3556 Paeonenoide Paeonenoide Paeonenoide C28H42O4 442.308 InChIKey=VIDISXWZNJLDBI-IDEZQVRVSA-N No Yes
3557 (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone C31H44O6 512.314 InChIKey=MUKGMGIRLLFCSI-HNLHEYJOSA-N No Yes
3558 (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-4.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-4.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy-4,13-dihydroxy-4.23-(isopropylidenedioxy)-24.30-dinorolean-20(29)-en-28-oic Acid 28,13-Lactone C31H44O6 512.314 InChIKey=UCWFZJRAFMGHGU-HNLHEYJOSA-N No Yes
3559 (3b,4b.11a.12a.13b)-11,12-Epoxy,13-dihydroxy-3.23-(isopropylidenedioxy)-30-norolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy,13-dihydroxy-3.23-(isopropylidenedioxy)-30-norolean-20(29)-en-28-oic Acid 28,13-Lactone (3b,4b.11a.12a.13b)-11,12-Epoxy,13-dihydroxy-3.23-(isopropylidenedioxy)-30-norolean-20(29)-en-28-oic Acid 28,13-Lactone C32H46O5 510.335 InChIKey=XUOFYJKRVBHVBO-JYRBIGNMSA-N No Yes
3560 3b,4a-4-Hydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-12,20(29)-dien-28-oic Acid 3b,4a-4-Hydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-12,20(29)-dien-28-oic Acid 3b,4a-4-Hydroxy-3.23-(isopropylidenedioxy)-24.30-dinorolean-12,20(29)-dien-28-oic Acid C31H46O5 498.335 InChIKey=FKAYNRSZPIPSRC-WVRQITKCSA-N No Yes
3561 Akenonic acid Akenonic acid Akenonic acid C29H44O3 440.329 InChIKey=XWVVPZWKCNXREE-VSQYQUPVSA-N No Yes
3562 23-Hydroxy-beta-amyrin 23-Hydroxy-beta-amyrin 23-Hydroxy-beta-amyrin C30H50O2 442.381 InChIKey=NTWLPZMPTFQYQI-OSKQWRSTSA-N No Yes
3563 6alpha-Hydroxyoleana-12-ene-3-one 6alpha-Hydroxyoleana-12-ene-3-one 6alpha-Hydroxyoleana-12-ene-3-one C30H48O2 440.365 InChIKey=YCTXVPCDHZMBHX-ITODWHPPSA-N No Yes
3564 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(1,12)-oleanane 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(1,12)-oleanane 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(1,12)-oleanane C30H46O6 502.329 InChIKey=NQLKLVWEPFMCHQ-OSQMWACDSA-N No Yes
3565 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(12)-oleanane 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(12)-oleanane 3-oxo-15 α,16 α,21 β,22 α,28-pentahydroxy-Delta(12)-oleanane C30H48O6 504.345 InChIKey=QIALAZVLXLEVEA-OSQMWACDSA-N No Yes
3566 R1-Barrigenol R1-Barrigenol R1-Barrigenol C30H50O6 506.361 InChIKey=DZVVEETZRZUXLI-RVWOYFKVSA-N No Yes
3567 Theasapogenol B Theasapogenol B Theasapogenol B C30H50O5 490.366 InChIKey=AYDKOFQQBHRXEW-AAUPIIFFSA-N No Yes
3569 Hederagonic acid Hederagonic acid Hederagonic acid C30H46O4 470.340 InChIKey=WCXZTKJFWJFMJG-AOIBKUJJSA-N No Yes
3570 Marsglobiferin Marsglobiferin Marsglobiferin C30H50O5 490.366 InChIKey=AYDKOFQQBHRXEW-SQNAMZIKSA-N No Yes
3572 Barringtogenin Barringtogenin Barringtogenin C30H50O5 490.366 InChIKey=AYDKOFQQBHRXEW-AAUPIIFFSA-N No Yes
3574 Protoaescigenin Protoaescigenin Protoaescigenin C30H50O6 506.361 InChIKey=VKJLHZZPVLQJKG-JAGYOTNFSA-N No Yes
3579 3beta-Acetoxy-11alpha,13beta-dihydroxyoleanane-12-one 3beta-Acetoxy-11alpha,13beta-dihydroxyoleanane-12-one 3beta-Acetoxy-11alpha,13beta-dihydroxyoleanane-12-one C32H52O5 516.381 InChIKey=USDSYLZMFDBWGE-MIAAUJDISA-N No Yes
3580 3beta,11alpha-Diacetoxy-13beta-hydroxyoleanane-12-one 3beta,11alpha-Diacetoxy-13beta-hydroxyoleanane-12-one 3beta,11alpha-Diacetoxy-13beta-hydroxyoleanane-12-one C34H54O6 558.392 InChIKey=DSICOADBIKAGSE-DPJQMALGSA-N No Yes
3581 3beta,11alpha-Dihydroxytaraxera-14-ene-12-one 3beta,11alpha-Dihydroxytaraxera-14-ene-12-one 3beta,11alpha-Dihydroxytaraxera-14-ene-12-one C30H48O3 456.360 InChIKey=RSFOLDGWWJZFSF-WLUUJYKASA-N No Yes
3582 3beta-Hydroxy-11alpha-acetoxytaraxera-14-ene-12-one 3beta-Hydroxy-11alpha-acetoxytaraxera-14-ene-12-one 3beta-Hydroxy-11alpha-acetoxytaraxera-14-ene-12-one C32H50O4 498.371 InChIKey=HLTDFXXGYPWHBC-HUYYHLCJSA-N No Yes
3583 3b,11a-Diacetoxytaraxer-14-en-12-one 3b,11a-Diacetoxytaraxer-14-en-12-one 3b,11a-Diacetoxytaraxer-14-en-12-one C34H52O5 540.381 InChIKey=PXQRPFXTGJZKHO-XVCZJDCXSA-N No Yes
3584 3b,11a-Dimethoxytaraxer-14-en-12-one 3b,11a-Dimethoxytaraxer-14-en-12-one 3b,11a-Dimethoxytaraxer-14-en-12-one C32H52O3 484.392 InChIKey=DMZGAXYWEUGMAV-HUYYHLCJSA-N No Yes
3585 3beta-(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyloxy)-23-hydroxyoleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyloxy)-23-hydroxyoleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyloxy)-23-hydroxyoleana-12-ene-28-oic acid beta-D-glucopyranosyl ester C47H76O18 928.503 InChIKey=KOQPPOSSMNKJPO-YWBCTTEYSA-N No Yes
3586 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-hydroxyoleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-hydroxyoleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-hydroxyoleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester C53H86O23 1090.556 InChIKey=RRHXEPNZJMTXPY-MFDXPVLDSA-N No Yes
3587 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester C53H86O22 1074.561 InChIKey=FNNMEJXCIARVCO-WGCVIKQWSA-N No Yes
3588 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-oxooleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-oxooleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[(2-O-beta-D-Glucopyranosyl-alpha-L-arabinopyranosyl)oxy]-27-oxooleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester C53H84O23 1088.540 InChIKey=JOWADQLAXQZPCZ-MFDXPVLDSA-N No Yes
3589 Longispinogenin 3-glucuronide Longispinogenin 3-glucuronide Longispinogenin 3-glucuronide C36H58O9 634.408 InChIKey=IYGXHRZVCNKBPQ-BDUACZOQSA-N No Yes
3590 21 β-benzoylsitakisogenin 3-O-β-D-glucuronopyranoside 21 β-benzoylsitakisogenin 3-O-β-D-glucuronopyranoside 21 β-benzoylsitakisogenin 3-O-β-D-glucuronopyranoside C43H62O10 738.434 InChIKey=ODKZOESVYGUXED-OUTAWVKJSA-N No Yes
3591 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester C48H78O18 942.519 InChIKey=NGLIQDUUYDLHKM-KXESMRJQSA-N No Yes
3592 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid C47H76O17 912.508 InChIKey=SAPHLLAJXWRHLX-KNBGHJLISA-N No Yes
3593 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester 3beta-[6-O-(6-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid beta-D-glucopyranosyl ester C53H86O22 1074.561 InChIKey=BEXDGRJTUXVAIT-OABPOYRQSA-N No Yes
3594 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester 3beta-[6-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyloxy]oleana-12-ene-28-oic acid 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester C54H88O23 1104.572 InChIKey=FUKCUDXOUWPKHZ-UGNBZHHOSA-N No Yes
3595 Helixoside A Helixoside A Helixoside A C54H88O24 1120.567 InChIKey=VKICMPRVQHZPRV-RTCRAJIBSA-N No Yes
3596 Helixoside B Helixoside B Helixoside B C54H88O23 1104.572 InChIKey=YPIHCZNMLNJVSW-NMEUZNJHSA-N No Yes
3597 TR-saponin A methyl ester TR-saponin A methyl ester TR-saponin A methyl ester C53H80O20 1036.524 InChIKey=QCMIZNQBGXTSJB-FAHXWNCJSA-N No Yes
3598 TR-saponinB methyl ester TR-saponinB methyl ester TR-saponinB methyl ester C53H82O20 1038.540 InChIKey=ZMCOBFSOEBDBKJ-IITVVFKISA-N No Yes
3599 3-O-a-L-arabinopyranosyl (1-3)-b-D-glucuronopyranosyl-21-O-angeloyl-22-O-2-methylbutanoyl-R1-barrigenol-23-oic acid 3-O-a-L-arabinopyranosyl (1-3)-b-D-glucuronopyranosyl-21-O-angeloyl-22-O-2-methylbutanoyl-R1-barrigenol-23-oic acid 3-O-a-L-arabinopyranosyl (1-3)-b-D-glucuronopyranosyl-21-O-angeloyl-22-O-2-methylbutanoyl-R1-barrigenol-23-oic acid C53H82O20 1038.540 InChIKey=ZMCOBFSOEBDBKJ-IITVVFKISA-N No Yes