β-D-Glucopyranosyl (1α,3β,4α,24S)-24-[(β-D-glucopyranosyloxy)methyl]-1,3,24-trihydroxy-9,19-cyclolanostan-28-oate

CAS Registry Number®

292167-40-9

CAS Name

β-D-Glucopyranosyl (1α,3β,4α,24S)-24-[(β-D-glucopyranosyloxy)methyl]-1,3,24-trihydroxy-9,19-cyclolanostan-28-oate

Molecular Formula

C43H72O16

Molecular Mass

845.02

Cite this Page

β-D-Glucopyranosyl (1α,3β,4α,24S)-24-[(β-D-glucopyranosyloxy)methyl]-1,3,24-trihydroxy-9,19-cyclolanostan-28-oate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=292167-40-9 (retrieved 2024-11-08) (CAS RN: 292167-40-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C43H72O16/c1-20(2)42(55,19-56-35-33(52)31(50)29(48)23(16-44)57-35)12-9-21(3)22-10-11-39(5)25-7-8-26-40(6,37(54)59-36-34(53)32(51)30(49)24(17-45)58-36)27(46)15-28(47)43(26)18-41(25,43)14-13-38(22,39)4/h20-36,44-53,55H,7-19H2,1-6H3/t21-,22-,23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33-,34-,35-,36+,38-,39+,40+,41+,42-,43-/m1/s1

InChIKey

InChIKey=NUJWBDOJBSCJEG-VMMOFQPISA-N

SMILES

O[C@@H]1[C@@]23[C@@]4(C2)[C@]([C@@]5(C)[C@](C)(CC4)[C@@]([C@@H](CC[C@@](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)([C@@H](C)C)O)C)(CC5)[H])(CC[C@]3([C@@](C(O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)=O)(C)[C@@H](O)C1)[H])[H]

Canonical SMILES

O=C(OC1OC(CO)C(O)C(O)C1O)C2(C)C(O)CC(O)C34CC54CCC6(C)C(CCC6(C)C5CCC23)C(C)CCC(O)(COC7OC(CO)C(O)C(O)C7O)C(C)C

Other Names for this Substance

  • 9,19-Cyclolanostan-28-oic acid, 24-[(β-D-glucopyranosyloxy)methyl]-1,3,24-trihydroxy-, β-D-glucopyranosyl ester, (1α,3β,4α,24S)-
  • β-D-Glucopyranosyl (1α,3β,4α,24S)-24-[(β-D-glucopyranosyloxy)methyl]-1,3,24-trihydroxy-9,19-cyclolanostan-28-oate
  • Cyclopassifloside III

CAS INSIGHTSTM
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