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Substance Name: Octadecyl 3-hydroxy-11-oxoolean-12-en-29-oate
RN: 13832-70-7
UNII: 3YYE6VJS0P
InChIKey: WNIFXKPDILJURQ-JKPOUOEOSA-N

Molecular Formula

  • C48-H82-O4

Molecular Weight

  • 723.1718
 
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Names and Synonyms

Name of Substance

  • Octadecyl 3-hydroxy-11-oxoolean-12-en-29-oate
  • Stearyl glycyrrhetinate

Synonym

  • UNII-3YYE6VJS0P

Systematic Name

  • Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, octadecyl ester, (3beta,20beta)-

Registry Numbers

CAS Registry Number

  • 13832-70-7

FDA UNII

  • 3YYE6VJS0P

System Generated Number

  • 0013832707

Structure Descriptors

InChI

1S/C48H82O4/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33-52-42(51)45(5)30-29-44(4)31-32-47(7)36(37(44)35-45)34-38(49)41-46(6)27-26-40(50)43(2,3)39(46)25-28-48(41,47)8/h34,37,39-41,50H,9-33,35H2,1-8H3/t37-,39-,40-,41+,44+,45-,46-,47+,48+/m0/s1

InChIKey

WNIFXKPDILJURQ-JKPOUOEOSA-N

Smiles

CCCCCCCCCCCCCCCCCCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1