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Chemistry, part 2

Content language

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Concept information

... > 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 > platycodon saponin 1
... > 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 > platycodon saponin 1
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > terpene glycoside > triterpenoid saponin > platycodon saponin 1
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > saponin > triterpenoid saponin > platycodon saponin 1

Preferred term

platycodon saponin 1  

Type

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

Broader concept

charge

  • 0

formula

  • C36H58O13

has_role

inchi

  • InChI=1S/C36H58O13/c1-30(2)8-9-35-21(12-30)36(49-29(35)46)22(41)10-20-31(3)11-17(40)27(48-28-26(45)25(44)24(43)18(14-37)47-28)34(15-38,16-39)19(31)6-7-32(20,4)33(36,5)13-23(35)42/h17-28,37-45H,6-16H2,1-5H3/t17-,18+,19+,20+,21+,22-,23+,24+,25-,26+,27-,28-,31-,32+,33-,35+,36+/m0/s1

inchikey

  • GOFIZNVEASPUFU-NFBWNAECSA-N

mass

  • 698.83790

monoisotopicmass

  • 698.38774

smiles

  • [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@H]1[C@@H](O)C[C@@]2(C)[C@@]([H])(CC[C@]3(C)[C@]2([H])C[C@H](O)[C@]24OC(=O)[C@@]5(CCC(C)(C)C[C@@]25[H])[C@H](O)C[C@@]34C)C1(CO)CO

subset

  • 2_STAR

synonym RELATED

  • 3-O-beta-D-glucopyranosyl-2beta,12alpha,16alpha,23,24-pentahydroxyoleanane-28(13)-lactone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66761

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