Limonin glucoside

CAS Registry Number®

123564-61-4

CAS Name

Limonin glucoside

Molecular Formula

C32H42O14

Molecular Mass

650.67

Cite this Page

Limonin glucoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=123564-61-4 (retrieved 2024-11-22) (CAS RN: 123564-61-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H42O14/c1-28(2)17-9-18(34)30(4)16(31(17)13-42-20(35)10-19(31)45-28)5-7-29(3,32(30)25(46-32)26(39)40)24(14-6-8-41-12-14)44-27-23(38)22(37)21(36)15(11-33)43-27/h6,8,12,15-17,19,21-25,27,33,36-38H,5,7,9-11,13H2,1-4H3,(H,39,40)/t15-,16+,17+,19+,21-,22+,23-,24+,25-,27+,29+,30+,31-,32-/m1/s1

InChIKey

InChIKey=FYIKIBQJAJRKQM-WNCNYDOCSA-N

SMILES

C[C@]12[C@]3([C@@]([C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C=5C=COC5)(C)CC[C@@]1([C@]67[C@@](CC2=O)(C(C)(C)O[C@]6(CC(=O)OC7)[H])[H])[H])[C@@H](C(O)=O)O3

Canonical SMILES

O=C(O)C1OC12C3(C(=O)CC4C(OC5CC(=O)OCC54C3CCC2(C)C(OC6OC(CO)C(O)C(O)C6O)C7=COC=C7)(C)C)C

Other Names for this Substance

  • Spiro[9H,11H-naphtho[1′,2′:3,4]furo[3,2-c]pyran-5(2H),2′-oxirane]-3′-carboxylic acid, 6-[(S)-3-furanyl(β-D-glucopyranosyloxy)methyl]decahydro-2,2,4a,6-tetramethyl-4,11-dioxo-, (2aR,3′S,4aS,5R,6S,8aR,8bR,12aS)-
  • Limonoic acid, 17-O-β-D-glucopyranosyl-, δ-lactone
  • (2aR,3′S,4aS,5R,6S,8aR,8bR,12aS)-6-[(S)-3-Furanyl(β-D-glucopyranosyloxy)methyl]decahydro-2,2,4a,6-tetramethyl-4,11-dioxospiro[9H,11H-naphtho[1′,2′:3,4]furo[3,2-c]pyran-5(2H),2′-oxirane]-3′-carboxylic acid
  • Spiro[9H,11H-naphtho[1′,2′:3,4]furo[3,2-c]pyran-5(2H),2′-oxirane]-3′-carboxylic acid, 6-[3-furanyl(β-D-glucopyranosyloxy)methyl]decahydro-2,2,4a,6-tetramethyl-4,11-dioxo-, [2aR-[2aα,4aα,5β(S*),6β(S*),8aα,8bR*,12aα]]-
  • Limonin glucoside

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration