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Substance Name: Bis-12,12'-diacetylbrusatolyl succinate
RN: 81612-59-1
InChIKey: QGUMPPZBPSNWRS-UHFFFAOYSA-N

Molecular Formula

  • C60-H70-O26

Molecular Weight

  • 1207.19
 
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Names and Synonyms

Results Name

  • Bis-12,12'-diacetylbrusatolyl succinate

Synonym

  • Bis-12,12'-diacetylbrusatolyl succinate

Systematic Name

  • Picras-3-en-21-oic acid, 3,3'-((1,4-dioxo-1,4-butanediyl)bis(oxy))bis(12-(acetyloxy)-13,20-epoxy-11-hydroxy-15-((3-methyl-1-oxo-2-butenyl)oxy)-2,16-dioxo-, dimethyl ester, (11beta,12alpha,15beta)-(11'beta,12'alpha,15'beta)-

Registry Numbers

CAS Registry Number

  • 81612-59-1

System Generated Number

  • 0081612591

Structure Descriptors

InChI

1S/C60H70O26/c1-23(2)15-37(67)85-43-47-57-21-77-59(47,53(73)75-11)49(79-27(7)61)39(69)45(57)55(9)19-31(63)41(25(5)29(55)17-33(57)81-51(43)71)83-35(65)13-14-36(66)84-42-26(6)30-18-34-58-22-78-60(54(74)76-12,48(58)44(52(72)82-34)86-38(68)16-24(3)4)50(80-28(8)62)40(70)46(58)56(30,10)20-32(42)64/h15-16,29-30,33-34,39-40,43-50,69-70H,13-14,17-22H2,1-12H3

InChIKey

QGUMPPZBPSNWRS-UHFFFAOYSA-N

Smiles

O(C(CCC(OC1=C(C)[C@@H]2C[C@@H]3[C@@]45[C@@H]([C@@H]([C@@H]([C@@]([C@@H]5[C@@H](OC(\C=C(\C)C)=O)C(=O)O3)(OC4)C(OC)=O)OC(C)=O)O)[C@@]2(C)CC1=O)=O)=O)C=1C(C[C@@]2([C@@H](C1C)C[C@@H]1[C@@]34[C@@H]([C@@H](C(O1)=O)OC(\C=C(\C)C)=O)[C@@]([C@@H]([C@@H]([C@@H]23)O)OC(C)=O)(OC4)C(OC)=O)C)=O