Cas no 121923-99-7 (Dictyotin C)

Dictyotin C structure
Dictyotin C structure
Product Name:Dictyotin C
CAS No:121923-99-7
MF:C20H34O
MW:290.48336648941
CID:162284
PubChem ID:23426650
Update Time:2024-02-29

Dictyotin C Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenol,4-[(1R)-1,5-dimethyl-4-hexen-1-yl]-1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-,(1S,4S,4aR,8aR)-
    • (1S)-4β-[(R)-6-Methyl-5-hepten-2-yl]-1,2,3,4,4aβ,7,8,8aα-octahydro-1,6-dimethylnaphthalen-1β-ol
    • 1-Naphthalenol,4-[(1R)-1,5-dimethyl-4-hexen-1-yl]-1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-,(1...
    • 1-Naphthalenol,4-(1,5-dimethyl-4-hexenyl)-1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-, [1S-[1a,4a(S*),4aa,8ab]]-
    • 1-Naphthalenol,4-[(1R)-1,5-dimethyl-4-hexenyl]-1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-,(1S,4S,4aR,8aR)- (9CI)
    • Dictyotin C
    • Dictyotin B
    • (1R,4S,4aR,8aR)-1,6-dimethyl-4-[(2R)-6-methylhept-5-en-2-yl]-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
    • 121923-98-6
    • 121923-99-7
    • (1S)-4beta-[(R)-6-Methyl-5-hepten-2-yl]-1,2,3,4,4abeta,7,8,8aalpha-octahydro-1,6-dimethylnaphthalen-1beta-ol
    • (1R)-4beta-[(R)-6-Methyl-5-hepten-2-yl]-1,2,3,4,4abeta,7,8,8aalpha-octahydro-1,6-dimethylnaphthalen-1alpha-ol
    • Inchi: 1S/C20H34O/c1-14(2)7-6-8-16(4)17-11-12-20(5,21)19-10-9-15(3)13-18(17)19/h7,13,16-19,21H,6,8-12H2,1-5H3/t16-,17+,18+,19-,20-/m1/s1
    • InChI Key: MEDDLWWQEUETQK-LCWAXJCOSA-N
    • SMILES: O[C@]1(C)CC[C@@H]([C@H](C)CC/C=C(\C)/C)[C@@H]2C=C(C)CC[C@H]21

Computed Properties

  • Exact Mass: 290.261
  • Monoisotopic Mass: 290.261
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 416
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 20.2
  • XLogP3: 5.3

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