Item 1 of 1 (back to results) rotundifolioside J A triterpenoid saponin that consists of urs-11-ene substituted by an epoxy group across positions 13 and 28, a hydroxy group at position 16 and a alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->2)-beta-D-fucopyranosyloxy residue at position 3 (the 3beta,16alpha stereoisomer). Isolated from Bupleurum rotundifolium, it exhibits antiproliferative activity against cancer cells.

Current search: 05. Industrial Uses: pharmaceutical [CHEBI:52217] > drug [CHEBI:23888] > antineoplastic agent [CHEBI:35610] > rotundifolioside J [CHEBI:66317] × Select any link to see items in a related category. more general categories    information about this item 03. Biological Effects of Specific Chemicals  03. Biological Effects of Specific Chemicals  biochemical uses [CHEBI:52206] (3306)   metabolite [CHEBI:25212] (2692)   secondary metabolite [CHEBI:26619] (2225)   rotundifolioside J [CHEBI:66317] (1) 05. Industrial Uses  05. Industrial Uses  pharmaceutical [CHEBI:52217] (1978)   drug [CHEBI:23888] (1930)   antineoplastic agent [CHEBI:35610] (760)   rotundifolioside J [CHEBI:66317] (1) 08. Chemical Category  08. Chemical Category  main group molecular entity [CHEBI:33579] (25650)   p-block molecular entity [CHEBI:33675] (25343)   chalcogen molecular entity [CHEBI:33304] (15225)   oxygen molecular entity [CHEBI:25806] (14414)   organooxygen compound [CHEBI:36963] (11352)   ether [CHEBI:25698] (876)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  glycosyl compound [CHEBI:63161] (1006)   glycoside [CHEBI:24400] (633)   saponin [CHEBI:26605] (94)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  terpene glycoside [CHEBI:61777] (68)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  carbohydrate derivative [CHEBI:63299] (2582)   oligosaccharide derivative [CHEBI:63563] (804)   trisaccharide derivative [CHEBI:63571] (187)   rotundifolioside J [CHEBI:66317] (1)  organochalcogen compound [CHEBI:36962] (11874)   organooxygen compound [CHEBI:36963] (11352)   ether [CHEBI:25698] (876)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  glycosyl compound [CHEBI:63161] (1006)   glycoside [CHEBI:24400] (633)   saponin [CHEBI:26605] (94)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  terpene glycoside [CHEBI:61777] (68)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  carbohydrate derivative [CHEBI:63299] (2582)   oligosaccharide derivative [CHEBI:63563] (804)   trisaccharide derivative [CHEBI:63571] (187)   rotundifolioside J [CHEBI:66317] (1)  carbon group molecular entity [CHEBI:33582] (23847)   organic molecular entity [CHEBI:50860] (23769)   lipid [CHEBI:18059] (3532)   isoprenoid [CHEBI:24913] (1402)   terpenoid [CHEBI:26873] (1099)   triterpenoid [CHEBI:36615] (228)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1)  terpene glycoside [CHEBI:61777] (68)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  isoprenoid [CHEBI:24913] (1402)   terpenoid [CHEBI:26873] (1099)   triterpenoid [CHEBI:36615] (228)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1)  terpene glycoside [CHEBI:61777] (68)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  heteroorganic entity [CHEBI:33285] (15197)   organic heterocyclic compound [CHEBI:24532] (5243)   oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  organochalcogen compound [CHEBI:36962] (11874)   organooxygen compound [CHEBI:36963] (11352)   ether [CHEBI:25698] (876)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  glycosyl compound [CHEBI:63161] (1006)   glycoside [CHEBI:24400] (633)   saponin [CHEBI:26605] (94)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  terpene glycoside [CHEBI:61777] (68)   triterpenoid saponin [CHEBI:61778] (59)   rotundifolioside J [CHEBI:66317] (1)  carbohydrate derivative [CHEBI:63299] (2582)   oligosaccharide derivative [CHEBI:63563] (804)   trisaccharide derivative [CHEBI:63571] (187)   rotundifolioside J [CHEBI:66317] (1)  organic molecule [CHEBI:72695] (11399)   organic cyclic compound [CHEBI:33832] (7633)   organic heterocyclic compound [CHEBI:24532] (5243)   oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  organic polycyclic compound [CHEBI:51958] (1654)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1)  polyatomic entity [CHEBI:36357] (18777)   molecule [CHEBI:25367] (11520)   cyclic compound [CHEBI:33595] (7817)   polycyclic compound [CHEBI:33635] (4078)   bridged compound [CHEBI:35990] (118)   rotundifolioside J [CHEBI:66317] (1)  organic polycyclic compound [CHEBI:51958] (1654)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1)  organic cyclic compound [CHEBI:33832] (7633)   organic heterocyclic compound [CHEBI:24532] (5243)   oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  organic polycyclic compound [CHEBI:51958] (1654)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1)  heterocyclic compound [CHEBI:5686] (5275)   organic heterocyclic compound [CHEBI:24532] (5243)   oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  organic molecule [CHEBI:72695] (11399)   organic cyclic compound [CHEBI:33832] (7633)   organic heterocyclic compound [CHEBI:24532] (5243)   oxacycle [CHEBI:38104] (2002)   cyclic ether [CHEBI:37407] (314)   rotundifolioside J [CHEBI:66317] (1)  organic polycyclic compound [CHEBI:51958] (1654)   hexacyclic triterpenoid [CHEBI:70994] (27)   rotundifolioside J [CHEBI:66317] (1) ChEBI Compound Accession Identifier:   [CHEBI:66317] ChEBI Compound Description:   A triterpenoid saponin that consists of urs-11-ene substituted by an epoxy group across positions 13 and 28, a hydroxy group at position 16 and a alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->2)-beta-D-fucopyranosyloxy residue at position 3 (the 3beta,16alpha stereoisomer). Isolated from Bupleurum rotundifolium, it exhibits antiproliferative activity against cancer cells. ChEBI Compound Identification Number:   66317 ChEBI InChI Value:   InChI=1S/C48H78O16/c1-21-10-16-47-20-58-48(39(47)22(21)2)17-12-27-44(7)14-13-29(43(5,6)26(44)11-15-45(27,8)46(48,9)18-28(47)50)62-41-37(34(55)31(52)24(4)60-41)64-42-38(35(56)32(53)25(19-49)61-42)63-40-36(57)33(54)30(51)23(3)59-40/h12,17,21-42,49-57H,10-11,13-16,18-20H2,1-9H3/t21-,22+,23+,24-,25-,26+,27-,28-,29+,30+,31+,32-,33-,34+,35+,36-,37-,38-,39-,40+,41+,42+,44+,45-,46+,47+,48+/m1/s1 ChEBI InChIKey Value:   YYFFLJVNDZHSNP-KNFUFYRCSA-N ChEBI Compound Name:   rotundifolioside J ChEBI SMILES Value:   [H][C@]1(O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C)O[C@@]1([H])O[C@H]1CC[C@@]2(C)[C@@]([H])(CC[C@]3(C)[C@]2([H])C=C[C@]24OC[C@@]5(CC[C@@H](C)[C@H](C)[C@@]25[H])[C@H](O)C[C@@]34C)C1(C)C ChEBI Substance ID:   160709880 ChEBI URL:   ChEBI:66317 ChemSpider ID:   9193600 Ontomatica Chemical Accession Key (OnChAKey):   YYFFLJVNDZHSNP_KNFUFYRCSA_N_000_000000 PubChem Compound ID:   11018417