4-(3-Hydroxy-1-buten-1-yl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside

CAS Registry Number®

137606-56-5

CAS Name

4-(3-Hydroxy-1-buten-1-yl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside

Molecular Formula

C25H42O12

Molecular Mass

534.59

Cite this Page

4-(3-Hydroxy-1-buten-1-yl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-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=137606-56-5 (retrieved 2024-11-24) (CAS RN: 137606-56-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H42O12/c1-11-7-13(8-25(3,4)14(11)6-5-12(2)27)35-24-22(33)20(31)18(29)16(37-24)10-34-23-21(32)19(30)17(28)15(9-26)36-23/h5-6,12-13,15-24,26-33H,7-10H2,1-4H3/t12?,13?,15-,16-,17-,18-,19+,20+,21-,22-,23-,24-/m1/s1

InChIKey

InChIKey=JZJSTNWTRLNQSL-KQOFVOKQSA-N

SMILES

O([C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C3CC(C)(C)C(C=CC(C)O)=C(C)C3

Canonical SMILES

OCC1OC(OCC2OC(OC3CC(=C(C=CC(O)C)C(C)(C)C3)C)C(O)C(O)C2O)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, 4-(3-hydroxy-1-buten-1-yl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-O-β-D-glucopyranosyl-
  • β-D-Glucopyranoside, 4-(3-hydroxy-1-butenyl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-O-β-D-glucopyranosyl-
  • 4-(3-Hydroxy-1-buten-1-yl)-3,5,5-trimethyl-3-cyclohexen-1-yl 6-O-β-D-glucopyranosyl-β-D-glucopyranoside

CAS INSIGHTSTM
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