CAS Registry Number®
6926-08-5
CAS Name
Harpagide
Molecular Formula
C15H24O10
Molecular Mass
364.35
Compound Properties
-
Melting Point (1)
129-130 °C
Source(s)
- (1) Alaniya, M. D.; Chemistry of Natural Compounds, (2014), 50(5), 842-845, CAplus
Other Names and Identifiers
InChI
InChI=1S/C15H24O10/c1-14(21)4-7(17)15(22)2-3-23-13(11(14)15)25-12-10(20)9(19)8(18)6(5-16)24-12/h2-3,6-13,16-22H,4-5H2,1H3/t6-,7-,8-,9+,10-,11-,12+,13+,14+,15-/m1/s1
InChIKey
InChIKey=XUWSHXDEJOOIND-YYDKPPGPSA-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@@](C)(O)C[C@H]2O)[H]
Canonical SMILES
OCC1OC(OC2OC=CC3(O)C(O)CC(O)(C)C23)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranoside, (1S,4aS,5R,7S,7aR)-1,4a,5,6,7,7a-hexahydro-4a,5,7-trihydroxy-7-methylcyclopenta[c]pyran-1-yl
- Glucopyranoside, 1β,4a,5,6,7,7aα-hexahydro-4aα,5α,7α-trihydroxy-7-methylcyclopenta[c]pyran-1-yl, β-D–
- Harpagide
- β-D-Glucopyranoside, 1,4a,5,6,7,7a-hexahydro-4a,5,7-trihydroxy-7-methylcyclopenta[c]pyran-1-yl, [1S-(1α,4aα,5α,7α,7aα)]-
- (1S,4aS,5R,7S,7aR)-1,4a,5,6,7,7a-Hexahydro-4a,5,7-trihydroxy-7-methylcyclopenta[c]pyran-1-yl β-D-glucopyranoside
Deleted or Replaced CAS Registry Numbers
28629-71-2
