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Substance Name: Bisabololoxide A
RN: 22567-36-8
UNII: 16AE65F94Y
InChIKey: WJHRAVIQWFQMKF-IPYPFGDCSA-N

Note

  • Induces apoptosis in rat thymocytes; from German chamomile (Matricaria recutita L.).

Molecular Formula

  • C15-H26-O2

Molecular Weight

  • 238.3684
 
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Names and Synonyms

Name of Substance

  • Bisabololoxide A

Synonyms

  • 2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-tetrahydro-2H-pyran-3-ol
  • 2,2,6-Trimethyl-6-(4-methyl-3-cyclohexen-1-yl)tetrahydro-2H-pyran-3-ol
  • BSBO cpd
  • EINECS 245-086-2
  • UNII-16AE65F94Y

Systematic Names

  • (3S-(3alpha,6alpha(R*)))-Tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3-ol
  • 2H-Pyran-3-ol, tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-, (3S-(3alpha,6alpha(R*)))-

Registry Numbers

CAS Registry Number

  • 22567-36-8

FDA UNII

  • 16AE65F94Y

System Generated Number

  • 0022567368

Structure Descriptors

InChI

InChI=1S/C15H26O2/c1-11-5-7-12(8-6-11)15(4)10-9-13(16)14(2,3)17-15/h5,12-13,16H,6-10H2,1-4H3/t12-,13+,15+/m1/s1

InChIKey

WJHRAVIQWFQMKF-IPYPFGDCSA-N

Smiles

CC1=CC[C@H](CC1)[C@]2(C)CC[C@H](O)C(C)(C)O2