Chemical Compound

Avarol

CAS Registry Number55303-98-5
Avarol chemical structure
Primary record

Avarol

CAS
55303-98-5
PubChem CID
72185
SMILES
C[C@H]1CC[C@]2([C@H]([C@]1(C)CC3=C(C=CC(=C3)O)O)CCC=C2C)C
Molecular Formula
C21H30O2
Molecular Weight
314.469
Exact Mass
314.2246
InChI
InChI=1S/C21H30O2/c1-14-6-5-7-19-20(14,3)11-10-15(2)21(19,4)13-16-12-17(22)8-9-18(16)23/h6,8-9,12,15,19,22-23H,5,7,10-11,13H2,1-4H3/t15-,19+,20+,21+/m0/s1
InChIKey
JSPUCPNQXKTYRO-LWILDLIXSA-N
LogP
5.4391
TPSA
40.46

Names and synonyms

  • Avarol
  • Avrol
  • 55303-98-5
  • KZX416VN2B
  • UNII-KZX416VN2B
  • AC1L2HLA
  • RefChem:115733
  • (+)-AVAROL
  • AC1Q7B8C
  • CHEMBL459814
  • SCHEMBL186460
  • DTXSID80203850
  • orb1740374
  • C21H30O2
  • NSC 306951
  • SCHEMBL31517137
  • CTK5A3373
  • DTXCID10126341
  • JSPUCPNQXKTYRO-LWILDLIXSA-N
  • NSC-306951
  • CID72185
  • ZINC5752044
  • AR-1D7201
  • BDBM50242257
  • MFCD01657132
  • NSC306951
  • C21-H30-O2
  • J12.828G
  • LS-30010
  • HY-121794