Deacetylnomilin

CAS Registry Number®

3264-90-2

CAS Name

Deacetylnomilin

Molecular Formula

C26H32O8

Molecular Mass

472.53

Cite this Page

Deacetylnomilin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3264-90-2 (retrieved 2024-11-13) (CAS RN: 3264-90-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    253-255 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C26H32O8/c1-22(2)15-10-17(28)25(5)14(24(15,4)16(27)11-18(29)33-22)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)34-20/h7,9,12,14-16,19-20,27H,6,8,10-11H2,1-5H3/t14-,15+,16+,19+,20-,23+,24-,25+,26-/m1/s1

InChIKey

InChIKey=HWAJASVMTDEFJN-NEFLTLJKSA-N

SMILES

C[C@]12[C@]34[C@](O3)(C(=O)O[C@H]([C@]4(C)CC[C@@]1([C@]5(C)[C@@](CC2=O)(C(C)(C)OC(=O)C[C@@H]5O)[H])[H])C=6C=COC6)[H]

Canonical SMILES

O=C1OC(C)(C)C2CC(=O)C3(C)C(CCC4(C)C(OC(=O)C5OC534)C6=COC=C6)C2(C)C(O)C1

Other Names for this Substance

  • Oxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione, 1-(3-furanyl)decahydro-11-hydroxy-4b,7,7,11a,13a-pentamethyl-, (1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-
  • Obacunoic acid, 1,2-dihydro-1-hydroxy-, ε-lactone, (1S)-
  • Nomilin, deacetyl-
  • (1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-1-(3-Furanyl)decahydro-11-hydroxy-4b,7,7,11a,13a-pentamethyloxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione
  • Deacetylnomilin

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