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Substance Name: Dryocrassin
RN: 12777-70-7
InChIKey: SEMUQEMWTSGBEN-UHFFFAOYSA-N

Molecular Formula

  • C43-H48-016

Molecular Weight

  • 820.8362
 
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Names and Synonyms

Name of Substance

  • Dryocrassin

Systematic Name

  • 2,5-Cyclohexadien-1-one, 2,2'-(methylenebis((2,4,6-trihydroxy-5-(1-oxobutyl)-3,1-phenylene)methylene)bis(6-acetyl-3,5-dihydroxy-

Registry Numbers

CAS Registry Number

  • 12777-70-7

System Generated Number

  • 0012777707

Structure Descriptors

InChI

1S/C43H48O16/c1-9-11-24(46)28-32(50)18(30(48)20(34(28)52)14-22-36(54)26(16(3)44)40(58)42(5,6)38(22)56)13-19-31(49)21(35(53)29(33(19)51)25(47)12-10-2)15-23-37(55)27(17(4)45)41(59)43(7,8)39(23)57/h48-53,56-59H,9-15H2,1-8H3

InChIKey

SEMUQEMWTSGBEN-UHFFFAOYSA-N

Smiles

CCCC(=O)c1c(c(c(c(c1O)CC2=C(C(C(=C(C2=O)C(=O)C)O)(C)C)O)O)Cc3c(c(c(c(c3O)C(=O)CCC)O)CC4=C(C(C(=C(C4=O)C(=O)C)O)(C)C)O)O)O