7G0

(1S,3aS,5S,7aS)-5-(4-hydroxyphenyl)-7a-methyloctahydro-1H-inden-1-ol


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Chemical Component Summary

Name(1S,3aS,5S,7aS)-5-(4-hydroxyphenyl)-7a-methyloctahydro-1H-inden-1-ol
Identifiers(1~{S},3~{a}~{S},5~{S},7~{a}~{S})-5-(4-hydroxyphenyl)-7~{a}-methyl-1,2,3,3~{a},4,5,6,7-octahydroinden-1-ol
FormulaC16 H22 O2
Molecular Weight246.345
TypeNON-POLYMER
Isomeric SMILESC[C@]12CC[C@@H](C[C@@H]1CC[C@@H]2O)c3ccc(cc3)O
InChIInChI=1S/C16H22O2/c1-16-9-8-12(10-13(16)4-7-15(16)18)11-2-5-14(17)6-3-11/h2-3,5-6,12-13,15,17-18H,4,7-10H2,1H3/t12-,13-,15-,16-/m0/s1
InChIKeyCEOUGJNTPKXUFS-SDADXPQNSA-N

Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count4
Bond Count42
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 44590574
ChEMBL CHEMBL460833
CCDC/CSD HONZUH