β-D-Glucopyranoside, (3β,6α,12β,24S)-20,24-epoxy-3,12,25-trihydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-, 6-acetate

CAS Registry Number®

156980-42-6

CAS Name

β-D-Glucopyranoside, (3β,6α,12β,24S)-20,24-epoxy-3,12,25-trihydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-, 6-acetate

Molecular Formula

C43H72O15

Molecular Mass

829.02

Cite this Page

β-D-Glucopyranoside, (3β,6α,12β,24S)-20,24-epoxy-3,12,25-trihydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-, 6-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=156980-42-6 (retrieved 2024-11-05) (CAS RN: 156980-42-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C43H72O15/c1-20(44)53-19-25-31(49)32(50)34(57-36-33(51)30(48)23(46)18-54-36)37(56-25)55-24-17-42(8)26(40(6)13-11-27(47)38(2,3)35(24)40)16-22(45)29-21(10-14-41(29,42)7)43(9)15-12-28(58-43)39(4,5)52/h21-37,45-52H,10-19H2,1-9H3

InChIKey

InChIKey=URPKGNJHPFKECW-UHFFFAOYSA-N

SMILES

CC12C3(C)C(C(CC3)C4(C)OC(C(C)(C)O)CC4)C(O)CC1C5(C)C(C(OC6C(OC7C(O)C(O)C(O)CO7)C(O)C(O)C(COC(C)=O)O6)C2)C(C)(C)C(O)CC5

Canonical SMILES

O=C(OCC1OC(OC2CC3(C)C(CC(O)C4C(CCC43C)C5(OC(CC5)C(O)(C)C)C)C6(C)CCC(O)C(C)(C)C26)C(OC7OCC(O)C(O)C7O)C(O)C1O)C

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,6α,12β,24S)-20,24-epoxy-3,12,25-trihydroxydammaran-6-yl 2-O-β-D-xylopyranosyl-, 6-acetate
  • Vinaginsenoside R2

CAS INSIGHTSTM
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