Melittoside

CAS Registry Number®

19467-03-9
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CAS Name

Melittoside

Molecular Formula

C21H32O15

Cite this Page

Melittoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19467-03-9 (retrieved 2024-09-07) (CAS RN: 19467-03-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    167-168 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H32O15/c22-4-7-3-10(25)21(36-20-17(31)15(29)13(27)9(6-24)34-20)1-2-32-18(11(7)21)35-19-16(30)14(28)12(26)8(5-23)33-19/h1-3,8-20,22-31H,4-6H2/t8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18+,19+,20+,21-/m1/s1

InChIKey

InChIKey=LZKBAGSBRBMVBE-GVKBFFPQSA-N

SMILES

O([C@]12[C@]([C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C1)(C(CO)=C[C@H]2O)[H])[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

OCC1=CC(O)C2(OC3OC(CO)C(O)C(O)C3O)C=COC(OC4OC(CO)C(O)C(O)C4O)C12

Other Names for this Substance

  • β-D-Glucopyranoside, (1S,4aS,5R,7aR)-5,7a-dihydro-5-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-1,4a(1H)-diyl bis-
  • Melittoside
  • β-D-Glucopyranoside, 5,7a-dihydro-5-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-1,4a(1H)-diyl bis-, [1S-(1α,4aα,5α,7aα)]-
  • (1S,4aS,5R,7aR)-5,7a-Dihydro-5-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-1,4a(1H)-diyl bis-β-D-glucopyranoside