Botrydial

CAS Registry Number®

54986-75-3
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CAS Name

Botrydial

Molecular Formula

C17H26O5

Molecular Mass

310.39

Cite this Page

Botrydial.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=54986-75-3 (retrieved 2024-03-28) (CAS RN: 54986-75-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H26O5/c1-10-6-13(22-11(2)20)14-15(3,4)8-16(5,9-19)17(14,21)12(10)7-18/h7,9-10,12-14,21H,6,8H2,1-5H3/t10-,12+,13+,14+,16-,17-/m1/s1

InChIKey

InChIKey=SJFIYVCSGNWVPJ-GKKOWQTJSA-N

SMILES

O[C@@]12[C@@]([C@@H](OC(C)=O)C[C@@H](C)[C@@H]1C=O)(C(C)(C)C[C@@]2(C=O)C)[H]

Canonical SMILES

O=CC1C(C)CC(OC(=O)C)C2C(C)(C)CC(C=O)(C)C12O

Other Names for this Substance

  • 1H-Indene-1,7-dicarboxaldehyde, 4-(acetyloxy)octahydro-7a-hydroxy-1,3,3,6-tetramethyl-, (1S,3aR,4S,6R,7S,7aS)-
  • 1H-Indene-1,7-dicarboxaldehyde, 4-(acetyloxy)octahydro-7a-hydroxy-1,3,3,6-tetramethyl-, [1S-(1α,3aα,4α,6α,7β,7aα)]-
  • (1S,3aR,4S,6R,7S,7aS)-4-(Acetyloxy)octahydro-7a-hydroxy-1,3,3,6-tetramethyl-1H-indene-1,7-dicarboxaldehyde
  • Botrydial
  • Botridial

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