Deacetyloleandrin

CAS Registry Number®

36190-93-9
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CAS Name

Deacetyloleandrin

Molecular Formula

C30H46O8

Molecular Mass

534.68

Cite this Page

Deacetyloleandrin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=36190-93-9 (retrieved 2024-07-04) (CAS RN: 36190-93-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    220-222 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H46O8/c1-16-27(33)23(35-4)13-25(37-16)38-19-7-9-28(2)18(12-19)5-6-21-20(28)8-10-29(3)26(17-11-24(32)36-15-17)22(31)14-30(21,29)34/h11,16,18-23,25-27,31,33-34H,5-10,12-15H2,1-4H3/t16-,18+,19-,20-,21+,22-,23-,25-,26-,27-,28-,29+,30-/m0/s1

InChIKey

InChIKey=ROKXRURUBUVHBD-QSHOECCGSA-N

SMILES

C[C@@]12[C@@](O)([C@]3([C@](CC1)([C@]4(C)[C@](CC3)(C[C@@H](O[C@H]5C[C@H](OC)[C@@H](O)[C@H](C)O5)CC4)[H])[H])[H])C[C@H](O)[C@@H]2C=6COC(=O)C6

Canonical SMILES

O=C1OCC(=C1)C2C(O)CC3(O)C4CCC5CC(OC6OC(C)C(O)C(OC)C6)CCC5(C)C4CCC23C

Other Names for this Substance

  • Card-20(22)-enolide, 3-[(2,6-dideoxy-3-O-methyl-L-arabino-hexopyranosyl)oxy]-14,16-dihydroxy-, (3β,5β,16β)-
  • Oleandrin, deacetyl-
  • Oleandrin, 16-deacetyl-
  • (3β,5β,16β)-3-[(2,6-Dideoxy-3-O-methyl-L-arabino-hexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
  • 16-Deacetyloleandrin

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Deleted or Replaced CAS Registry Numbers

11004-87-8