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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > tetrasaccharide derivative > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > pentacyclic triterpenoid > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > terpene glycoside > triterpenoid saponin > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene glycoside > triterpenoid saponin > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > terpene glycoside > triterpenoid saponin > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > saponin > triterpenoid saponin > oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]

Preferred term

oleanolic acid 3-o-[o-beta-d-glucopyranosyl-(1->4)-o-beta-d-glucopyranosyl-(1->3)-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranoside]  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C53H86O21

has_functional_parent

has_parent_hydride

inchi

  • InChI=1S/C53H86O21/c1-23-32(57)41(73-44-38(63)36(61)40(28(21-55)70-44)72-43-37(62)35(60)34(59)27(20-54)69-43)39(64)45(68-23)74-42-33(58)26(56)22-67-46(42)71-31-12-13-50(6)29(49(31,4)5)11-14-52(8)30(50)10-9-24-25-19-48(2,3)15-17-53(25,47(65)66)18-16-51(24,52)7/h9,23,25-46,54-64H,10-22H2,1-8H3,(H,65,66)/t23-,25-,26-,27+,28+,29-,30+,31-,32-,33-,34+,35-,36+,37+,38+,39+,40+,41+,42+,43-,44-,45-,46-,50-,51+,52+,53-/m0/s1

inchikey

  • VDRZQZWUCOHKED-BXROMGGZSA-N

mass

  • 1059.23730

monoisotopicmass

  • 1058.56616

smiles

  • [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](CO)O[C@@]([H])(O[C@@H]2[C@@H](O)[C@H](C)O[C@@]([H])(O[C@@H]3[C@@H](O)[C@@H](O)CO[C@@]3([H])O[C@H]3CC[C@@]4(C)[C@@]([H])(CC[C@]5(C)[C@]4([H])CC=C4[C@]6([H])CC(C)(C)CC[C@@]6(CC[C@@]54C)C(O)=O)C3(C)C)[C@@H]2O)[C@H](O)[C@H]1O

subset

  • 3_STAR

synonym EXACT

  • (3beta)-3-{[beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->2)-alpha-L-arabinopyranosyl]oxy}olean-12-en-28-oic acid
  • oleanolic acid 3-O-[O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->3)-O-alpha-L-rhamnopyranosyl-(1->2)-alpha-L-arabinopyranoside]

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66818

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