(3β,12β)-12,20-Dihydroxydammar-24-en-3-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside

CAS Registry Number®

59252-86-7
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CAS Name

(3β,12β)-12,20-Dihydroxydammar-24-en-3-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside

Molecular Formula

C41H70O12

Molecular Mass

754.99

Cite this Page

(3β,12β)-12,20-Dihydroxydammar-24-en-3-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59252-86-7 (retrieved 2024-08-27) (CAS RN: 59252-86-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C41H70O12/c1-21(2)10-9-14-41(8,49)22-11-16-40(7)29(22)23(42)18-27-38(5)15-13-28(37(3,4)26(38)12-17-39(27,40)6)53-36-34(48)32(46)31(45)25(52-36)20-51-35-33(47)30(44)24(43)19-50-35/h10,22-36,42-49H,9,11-20H2,1-8H3

InChIKey

InChIKey=DGSOBIYFLJXVQZ-UHFFFAOYSA-N

SMILES

CC12C3(C)C(C(C(CCC=C(C)C)(C)O)CC3)C(O)CC1C4(C)C(CC2)C(C)(C)C(OC5OC(COC6C(O)C(O)C(O)CO6)C(O)C(O)C5O)CC4

Canonical SMILES

OC1COC(OCC2OC(OC3CCC4(C)C(CCC5(C)C4CC(O)C6C(CCC65C)C(O)(C)CCC=C(C)C)C3(C)C)C(O)C(O)C2O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,12β)-12,20-dihydroxydammar-24-en-3-yl 6-O-β-D-xylopyranosyl-
  • (3β,12β)-12,20-Dihydroxydammar-24-en-3-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside
  • Chikusetsusaponin Ia
  • (-)-Chikusetsusaponin Ia

Deleted or Replaced CAS Registry Numbers

155658-73-4