(3β,5α,24S,25S)-3-[(6-O-α-L-Arabinopyranosyl-β-D-glucopyranosyl)oxy]-24-(β-D-glucopyranosyloxy)spirostan-6-one

CAS Registry Number®

200483-13-2

CAS Name

(3β,5α,24S,25S)-3-[(6-O-α-L-Arabinopyranosyl-β-D-glucopyranosyl)oxy]-24-(β-D-glucopyranosyloxy)spirostan-6-one

Molecular Formula

C44H70O19

Molecular Mass

903.02

Cite this Page

(3β,5α,24S,25S)-3-[(6-O-α-L-Arabinopyranosyl-β-D-glucopyranosyl)oxy]-24-(β-D-glucopyranosyloxy)spirostan-6-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=200483-13-2 (retrieved 2024-11-13) (CAS RN: 200483-13-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C44H70O19/c1-17-14-58-44(12-27(17)60-41-38(55)34(51)32(49)28(13-45)61-41)18(2)30-26(63-44)11-22-20-10-24(46)23-9-19(5-7-42(23,3)21(20)6-8-43(22,30)4)59-40-37(54)35(52)33(50)29(62-40)16-57-39-36(53)31(48)25(47)15-56-39/h17-23,25-41,45,47-55H,5-16H2,1-4H3/t17-,18-,19-,20+,21-,22-,23+,25-,26-,27-,28+,29+,30-,31-,32+,33+,34-,35-,36+,37+,38+,39-,40+,41+,42+,43-,44+/m0/s1

InChIKey

InChIKey=IYLGRZBRMFMEOH-UKUFTYSTSA-N

SMILES

C[C@@H]1[C@]2(O[C@@]3([C@]1([C@]4(C)[C@@](C3)([C@]5([C@](CC4)([C@]6(C)[C@@](C(=O)C5)(C[C@@H](O[C@@H]7O[C@H](CO[C@H]8[C@H](O)[C@@H](O)[C@@H](O)CO8)[C@@H](O)[C@H](O)[C@H]7O)CC6)[H])[H])[H])[H])[H])[H])C[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](C)CO2

Canonical SMILES

O=C1CC2C(CCC3(C)C2CC4OC5(OCC(C)C(OC6OC(CO)C(O)C(O)C6O)C5)C(C)C43)C7(C)CCC(OC8OC(COC9OCC(O)C(O)C9O)C(O)C(O)C8O)CC17

Other Names for this Substance

  • Spirostan-6-one, 3-[(6-O-α-L-arabinopyranosyl-β-D-glucopyranosyl)oxy]-24-(β-D-glucopyranosyloxy)-, (3β,5α,24S,25S)-
  • (3β,5α,24S,25S)-3-[(6-O-α-L-Arabinopyranosyl-β-D-glucopyranosyl)oxy]-24-(β-D-glucopyranosyloxy)spirostan-6-one
  • Chinenoside VI

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles