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Chemistry, part 2

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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 > rel-6'-o-cinnamoyl-8-o-(6'-o-cinnamoylglucopyranosyl)mussaenosidic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene glycoside > rel-6'-o-cinnamoyl-8-o-(6'-o-cinnamoylglucopyranosyl)mussaenosidic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > terpene glycoside > rel-6'-o-cinnamoyl-8-o-(6'-o-cinnamoylglucopyranosyl)mussaenosidic acid

Preferred term

rel-6'-o-cinnamoyl-8-o-(6'-o-cinnamoylglucopyranosyl)mussaenosidic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C40H46O17

has_role

inchi

  • InChI=1S/C40H46O17/c1-40(57-39-35(48)33(46)31(44)26(55-39)20-52-28(42)15-13-22-10-6-3-7-11-22)17-16-23-24(36(49)50)18-53-37(29(23)40)56-38-34(47)32(45)30(43)25(54-38)19-51-27(41)14-12-21-8-4-2-5-9-21/h2-15,18,23,25-26,29-35,37-39,43-48H,16-17,19-20H2,1H3,(H,49,50)/b14-12+,15-13+/t23-,25+,26+,29-,30+,31+,32-,33-,34+,35+,37-,38-,39-,40-/m0/s1

inchikey

  • GFPVMLGOXDZRCV-QAQKAEDJSA-N

mass

  • 798.78300

monoisotopicmass

  • 798.27350

smiles

  • [H][C@]1(O[C@H](COC(=O)/C=C/c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1OC=C(C(O)=O)[C@]2([H])CC[C@](C)(O[C@@H]3O[C@H](COC(=O)/C=C/c4ccccc4)[C@@H](O)[C@H](O)[C@H]3O)[C@]12[H]

subset

  • 2_STAR

synonym RELATED

  • (1S,4aS,7S,7aS)-7-Methyl-1,7-bis({6-O-[(2E)-3-phenyl-2-propenoyl]-beta-D-glucopyranosyl}oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:67349

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