(3β,6β,12β,23E)-3,12,25-Trihydroxydammar-23-ene-6,20-diyl bis-β-D-glucopyranoside

CAS Registry Number®

226712-34-1

CAS Name

(3β,6β,12β,23E)-3,12,25-Trihydroxydammar-23-ene-6,20-diyl bis-β-D-glucopyranoside

Molecular Formula

C42H72O15

Molecular Mass

817.01

Cite this Page

(3β,6β,12β,23E)-3,12,25-Trihydroxydammar-23-ene-6,20-diyl bis-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=226712-34-1 (retrieved 2024-12-25) (CAS RN: 226712-34-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H72O15/c1-37(2,53)12-9-13-42(8,57-36-33(52)31(50)29(48)24(19-44)56-36)20-10-15-40(6)27(20)21(45)16-25-39(5)14-11-26(46)38(3,4)34(39)22(17-41(25,40)7)54-35-32(51)30(49)28(47)23(18-43)55-35/h9,12,20-36,43-53H,10-11,13-19H2,1-8H3/b12-9+/t20-,21+,22+,23+,24+,25+,26-,27-,28+,29+,30-,31-,32+,33+,34-,35+,36-,39+,40+,41+,42-/m0/s1

InChIKey

InChIKey=HMCPMOZTKYWJSJ-QUICLGIDSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@]([C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C1)(C(C)(C)[C@@H](O)CC3)[H])(C[C@@H](O)[C@]5([C@@]2(C)CC[C@@]5([C@@](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)(C/C=C/C(C)(C)O)C)[H])[H])[H]

Canonical SMILES

OCC1OC(OC2CC3(C)C(CC(O)C4C(CCC43C)C(OC5OC(CO)C(O)C(O)C5O)(C)CC=CC(O)(C)C)C6(C)CCC(O)C(C)(C)C26)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,6β,12β,23E)-3,12,25-trihydroxydammar-23-ene-6,20-diyl bis-
  • (3β,6β,12β,23E)-3,12,25-Trihydroxydammar-23-ene-6,20-diyl bis-β-D-glucopyranoside
  • Vinaginsenoside R15

CAS INSIGHTSTM
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