Terpentecin

CAS Registry Number®

100440-25-3
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CAS Name

Terpentecin

Molecular Formula

C20H28O6

Molecular Mass

364.43

Cite this Page

Terpentecin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=100440-25-3 (retrieved 2024-05-02) (CAS RN: 100440-25-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C20H28O6/c1-11-6-5-7-13-18(3,12(2)16(24)17(25)19(11,13)4)8-14(22)20(10-26-20)15(23)9-21/h6,9,12-14,16,22,24H,5,7-8,10H2,1-4H3/t12-,13+,14-,16-,18-,19-,20+/s2

InChIKey

InChIKey=ISTOHHFNKVUOKP-OOKAXWEHNA-N

SMILES

[C@H](C[C@@]1(C)[C@]2([C@](C)(C(=O)[C@H](O)[C@H]1C)C(C)=CCC2)[H])(O)[C@]3(C(C=O)=O)CO3

Canonical SMILES

O=CC(=O)C1(OC1)C(O)CC2(C)C(C)C(O)C(=O)C3(C(=CCCC32)C)C

Other Names for this Substance

  • 2-Oxiraneacetaldehyde, 2-[(1R)-1-hydroxy-2-[(1S,2S,3R,4aS,8aS)-1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-1,2,4a,5-tetramethyl-4-oxo-1-naphthalenyl]ethyl]-α-oxo-, (2S)-rel-(-)-
  • Oxiraneacetaldehyde, 2-[1-hydroxy-2-(1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-1,2,4a,5-tetramethyl-4-oxo-1-naphthalenyl)ethyl]-α-oxo-, [1α[S*(R*)],2α,3β,4aβ,8aα]-(-)-
  • Oxiraneacetaldehyde, 2-[(1R)-1-hydroxy-2-[(1S,2S,3R,4aS,8aS)-1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-1,2,4a,5-tetramethyl-4-oxo-1-naphthalenyl]ethyl]-α-oxo-, (2S)-rel-(-)-
  • rel-(-)-(2S)-2-[(1R)-1-Hydroxy-2-[(1S,2S,3R,4aS,8aS)-1,2,3,4,4a,7,8,8a-octahydro-3-hydroxy-1,2,4a,5-tetramethyl-4-oxo-1-naphthalenyl]ethyl]-α-oxo-2-oxiraneacetaldehyde
  • Terpentecin

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