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Cedran-diol, 8S,13-

PubChem CID: 536384

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Compound Synonyms Cedrane-8,13-diol #, Cedran-diol, 8S,13-, YULHLOUAHSEHLD-UHFFFAOYSA-N
Topological Polar Surface Area 40.5
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 17.0
Isotope Atom Count 0.0
Molecular Complexity 342.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 6-(hydroxymethyl)-2,6,8-trimethyltricyclo[5.3.1.01,5]undecan-8-ol
Prediction Hob 0.0
Xlogp 2.7
Molecular Formula C15H26O2
Prediction Swissadme 0.0
Inchi Key YULHLOUAHSEHLD-UHFFFAOYSA-N
Fcsp3 1.0
Logs -2.183
Rotatable Bond Count 1.0
Logd 1.801
Compound Name Cedran-diol, 8S,13-
Prediction Hob Swissadme 0.0
Exact Mass 238.193
Formal Charge 0.0
Monoisotopic Mass 238.193
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 238.37
Covalent Unit Count 1.0
Total Atom Stereocenter Count 6.0
Total Bond Stereocenter Count 0.0
Esol -2.9277002000000003
Inchi InChI=1S/C15H26O2/c1-10-4-5-11-13(2,9-16)12-8-15(10,11)7-6-14(12,3)17/h10-12,16-17H,4-9H2,1-3H3
Smiles CC1CCC2C13CCC(C(C3)C2(C)CO)(C)O
Nring 3.0
Defined Bond Stereocenter Count 0.0