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Substance Name: Myriceric acid C
RN: 162059-94-1
UNII: WUX1YPQ76E
InChIKey: OQOHHYHCCUJBHE-HQEPTUIISA-N

Molecular Weight

  • 796.992
 
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Names and Synonyms

Name of Substance

  • Myriceric acid C

Synonyms

  • Olean-12-en-28-oic acid, 3,27-bis(((2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl)oxy)-, (3beta)-
  • Olean-12-en-28-oic acid, 3,27-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-, (3beta(E),27(E))-
  • UNII-WUX1YPQ76E

Registry Numbers

CAS Registry Number

  • 162059-94-1

FDA UNII

  • WUX1YPQ76E

System Generated Number

  • 0162059941

Structure Descriptors

InChI

1S/C48H60O10/c1-43(2)21-22-47(42(55)56)23-24-48(28-57-40(53)15-9-29-7-12-33(49)35(51)25-29)31(32(47)27-43)11-14-38-45(5)19-18-39(44(3,4)37(45)17-20-46(38,48)6)58-41(54)16-10-30-8-13-34(50)36(52)26-30/h7-13,15-16,25-26,32,37-39,49-52H,14,17-24,27-28H2,1-6H3,(H,55,56)/b15-9+,16-10+/t32-,37-,38+,39-,45-,46+,47-,48-/m0/s1

InChIKey

OQOHHYHCCUJBHE-HQEPTUIISA-N

Smiles

CC1(C)CC[C@@]2(CC[C@]3(COC(=O)\C=C\c4ccc(O)c(O)c4)C(=CC[C@@H]5[C@@]6(C)CC[C@H](OC(=O)\C=C\c7ccc(O)c(O)c7)C(C)(C)[C@@H]6CC[C@@]35C)[C@@H]2C1)C(=O)O