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Substance Name: 15-Demethyl plumieride
RN: 133738-37-1
InChIKey: XFIOZCMKPNZOII-RJMCEWFISA-N

Note

  • A type of MONOTERPENES, derived from geraniol. They have the general form of cyclopentanopyran, but in some cases, one of the rings is broken as in the case of secoiridoid. They are different from the similarly named iridals (TRITERPENES).

Molecular Formula

  • C20-H24-O12

Molecular Weight

  • 456.3976
 
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Names and Synonyms

Results Name

  • 15-Demethyl plumieride

MeSH Heading

  • Iridoids

Synonyms

  • 15-Demethyl plumieride
  • Iridoid

Systematic Name

  • Spiro(cyclopenta(c)pyran-7(1H),2'(5'H)-furan)-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(hydroxymethyl)-5'-oxo-, methyl ester, (1S-(1alpha,4aalpha,7a,7aalpha))-

Registry Numbers

CAS Registry Number

  • 133738-37-1

System Generated Number

  • 0133738371

Structure Descriptors

InChI

InChI=1S/C20H24O12/c1-28-17(27)10-7-29-18(31-19-15(25)14(24)13(23)11(6-22)30-19)12-9(10)2-3-20(12)4-8(5-21)16(26)32-20/h2-4,7,9,11-15,18-19,21-25H,5-6H2,1H3/t9-,11-,12-,13-,14+,15-,18+,19+,20-/m1/s1

InChIKey

XFIOZCMKPNZOII-RJMCEWFISA-N

Smiles

COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1C=C[C@]34OC(=O)C(=C4)CO