(3β,12β)-12,20,24,25-Tetrahydroxydammaran-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside

CAS Registry Number®

336161-28-5

CAS Name

(3β,12β)-12,20,24,25-Tetrahydroxydammaran-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside

Molecular Formula

C42H74O15

Molecular Mass

819.03

Cite this Page

(3β,12β)-12,20,24,25-Tetrahydroxydammaran-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=336161-28-5 (retrieved 2024-11-25) (CAS RN: 336161-28-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H74O15/c1-37(2)24-10-15-40(6)25(17-21(45)28-20(9-14-41(28,40)7)42(8,53)16-11-26(46)38(3,4)52)39(24,5)13-12-27(37)56-36-34(32(50)30(48)23(19-44)55-36)57-35-33(51)31(49)29(47)22(18-43)54-35/h20-36,43-53H,9-19H2,1-8H3/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=UGMWBGKFEUXCMG-ZYMJOECZSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@](CC1)(C(C)(C)[C@@H](O[C@H]4[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@@H](CO)O4)CC3)[H])(C[C@@H](O)[C@]6([C@@]2(C)CC[C@@]6([C@@](CCC(C(C)(C)O)O)(C)O)[H])[H])[H]

Canonical SMILES

OCC1OC(OC2C(O)C(O)C(OC2OC3CCC4(C)C(CCC5(C)C4CC(O)C6C(CCC65C)C(O)(C)CCC(O)C(O)(C)C)C3(C)C)CO)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,12β)-12,20,24,25-tetrahydroxydammaran-3-yl 2-O-β-D-glucopyranosyl-
  • (3β,12β)-12,20,24,25-Tetrahydroxydammaran-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
  • Quinquenoside F1

CAS INSIGHTSTM
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