β-D-Glucopyranoside, (3β,4β,220)-3,22-dihydroxyolean-12-en-23-yl
CAS Registry Number®
115334-08-2
CAS Name
β-D-Glucopyranoside, (3β,4β,220)-3,22-dihydroxyolean-12-en-23-ylMolecular Formula
C36H60O8Molecular Mass
620.86Cite this Page
β-D-Glucopyranoside, (3β,4β,220)-3,22-dihydroxyolean-12-en-23-yl. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=115334-08-2 (retrieved ) (CAS RN: 115334-08-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
278-280 °C (decomp)
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C36H60O8/c1-31(2)16-21-20-8-9-24-33(4)12-11-25(38)34(5,19-43-30-29(42)28(41)27(40)22(18-37)44-30)23(33)10-13-36(24,7)35(20,6)15-14-32(21,3)26(39)17-31/h8,21-30,37-42H,9-19H2,1-7H3/t21-,22+,23+,24+,25-,26+,27+,28-,29+,30+,32+,33-,34+,35+,36+/m0/s1
InChIKey
InChIKey=YTOCWWQIMKHRPX-LMOAGLASSA-N
SMILES
C[C@]12[C@@]3(C)C([C@]4([C@@](C)(CC3)[C@H](O)CC(C)(C)C4)[H])=CC[C@@]1([C@]5(C)[C@@](CC2)([C@](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)(C)[C@@H](O)CC5)[H])[H]
Canonical SMILES
OCC1OC(OCC2(C)C(O)CCC3(C)C4CC=C5C6CC(C)(C)CC(O)C6(C)CCC5(C)C4(C)CCC23)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranoside, (3β,4β,220)-3,22-dihydroxyolean-12-en-23-yl
- Oleanane, β-D-glucopyranoside deriv.