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Substance Name: Uvaol
RN: 545-46-0
UNII: W599R31ROT
InChIKey: XUARCIYIVXVTAE-ZAPOICBTSA-N

Note

  • From Vauquelinia corymbosa (Rosaceae).

Molecular Formula

  • C30-H50-O2

Molecular Weight

  • 442.723
 
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Names and Synonyms

Name of Substance

  • Uvaol

Synonyms

  • EINECS 208-888-3
  • NSC 159627
  • UNII-W599R31ROT
  • Uvaol

Systematic Names

  • (3beta)-Urs-12-ene-3,28-diol
  • Urs-12-ene-3beta,28-diol

Registry Numbers

CAS Registry Number

  • 545-46-0

FDA UNII

  • W599R31ROT

System Generated Number

  • 0000545460

Structure Descriptors

InChI

1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1

InChIKey

XUARCIYIVXVTAE-ZAPOICBTSA-N

Smiles

C=12[C@H]3[C@@](CC[C@@]2(C)[C@@]2(CC[C@@H]4[C@@]([C@H]2CC1)(CC[C@@H](O)C4(C)C)C)C)(CC[C@H]([C@@H]3C)C)CO