Verbenalin

CAS Registry Number®

548-37-8

CAS Name

Verbenalin

Molecular Formula

C17H24O10

Molecular Mass

388.37

Cite this Page

Verbenalin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=548-37-8 (retrieved 2024-11-21) (CAS RN: 548-37-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    183 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H24O10/c1-6-3-8(19)11-7(15(23)24-2)5-25-16(10(6)11)27-17-14(22)13(21)12(20)9(4-18)26-17/h5-6,9-14,16-18,20-22H,3-4H2,1-2H3/t6-,9+,10+,11-,12+,13-,14+,16-,17-/m0/s1

InChIKey

InChIKey=HLXRWTJXGMHOFN-XJSNKYLASA-N

SMILES

O([C@H]1[C@]2([C@@](C(C(OC)=O)=CO1)(C(=O)C[C@@H]2C)[H])[H])[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(=O)CC3C

Other Names for this Substance

  • Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, (1S,4aS,7S,7aR)-
  • Verbenalin
  • Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, [1S-(1α,4aα,7α,7aα)]-
  • Verbenaloside
  • Cornin (glycoside)

View All

Deleted or Replaced CAS Registry Numbers

1391-15-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration