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03. Biological Effects of Specific Chemicals
03. Biological Effects of Specific Chemicals
gummiferaoside B [CHEBI:65987] (1)
05. Industrial Uses
05. Industrial Uses
gummiferaoside B [CHEBI:65987] (1)
08. Chemical Category
08. Chemical Category
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
gummiferaoside B [CHEBI:65987] (1)
ChEBI Compound Accession Identifier :
[CHEBI:65987]
ChEBI Compound Description :
A triterpenoid saponin isolated from the roots of of the Madagascan plant Albizia gummifera and has been shown to exhibit cytotoxicity against human ovarian cancer cell line.
ChEBI Compound Identification Number :
65987
ChEBI InChI Value :
InChI=1S/C102H162O48/c1-18-97(13,149-89-75(125)65(115)58(108)42(5)134-89)29-21-23-41(4)84(129)143-78-44(7)137-90(77(127)71(78)121)150-98(14,19-2)28-20-22-40(3)83(128)141-57-34-102(94(130)148-93-82(68(118)63(113)51(36-104)139-93)146-87-76(126)70(120)79(45(8)136-87)144-85-72(122)60(110)48(105)37-131-85)47(32-95(57,9)10)46-24-25-54-99(15)30-27-56(96(11,12)53(99)26-31-100(54,16)101(46,17)33-55(102)107)142-92-81(147-88-74(124)66(116)62(112)50(35-103)138-88)69(119)64(114)52(140-92)39-133-91-80(67(117)59(109)43(6)135-91)145-86-73(123)61(111)49(106)38-132-86/h18-19,22-24,42-45,47-82,85-93,103-127H,1-2,20-21,25-39H2,3-17H3/b40-22+,41-23+/t42-,43-,44-,45-,47+,48-,49+,50-,51-,52-,53+,54-,55-,56+,57+,58-,59+,60+,61+,62-,63-,64-,65+,66+,67+,68+,69+,70-,71-,72-,73-,74-,75-,76+,77-,78-,79-,80-,81-,82-,85+,86+,87-,88+,89+,90+,91-,92+,93+,97+,98-,99+,100-,101-,102-/m1/s1
ChEBI InChIKey Value :
WWTIDCRMMJEMDR-WLGZQPPQSA-N
ChEBI Compound Name :
gummiferaoside B
ChEBI SMILES Value :
[H][C@]1(OC[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](C)O[C@]([H])(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC(=O)[C@]23C[C@H](OC(=O)C(\C)=C\CC[C@](C)(O[C@@H]4O[C@H](C)[C@@H](OC(=O)C(\C)=C\CC[C@@](C)(O[C@@H]5O[C@H](C)[C@@H](O)[C@H](O)[C@H]5O)C=C)[C@H](O)[C@H]4O)C=C)C(C)(C)C[C@@]2([H])C2=CC[C@]4([H])[C@@]5(C)CC[C@H](O[C@]6([H])O[C@H](CO[C@@H]7O[C@H](C)[C@H](O)[C@H](O)[C@H]7O[C@]7([H])OC[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O[C@]6([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]2(C)C[C@H]3O)[C@@H](O)[C@H]1O
ChEBI Substance ID :
160710061
ChEBI URL :
ChEBI:65987
ChemSpider ID :
NS
Ontomatica Chemical Accession Key (OnChAKey) :
WWTIDCRMMJEMDR_WLGZQPPQSA_N_000_000000
PubChem Compound ID :
70697837