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Substance Name: Paciforgine
RN: 136440-72-7
InChIKey: XJGKKCBILDDTEC-SQKGQWCESA-N

Note

  • Isolated from Paciforgia sp-2.

Molecular Formula

  • C21-H34-O8

Molecular Weight

  • 414.492
 
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Names and Synonyms

Name of Substance

  • Paciforgine

Synonym

  • Paciforgin

Systematic Name

  • Oxacyclotetradec-13-ene-2,10-dione, 5,6,7,11-tetrahydroxy-3-(3-hydroxy-2-propenyl)-4,7,9,13,14-pentamethyl-

Registry Numbers

CAS Registry Number

  • 136440-72-7

System Generated Number

  • 0136440727

Structure Descriptors

InChI

1S/C21H34O8/c1-11-9-16(23)17(24)12(2)10-21(5,28)19(26)18(25)13(3)15(7-6-8-22)20(27)29-14(11)4/h6,8,12-13,15-16,18-19,22-23,25-26,28H,7,9-10H2,1-5H3/b8-6+,14-11-

InChIKey

XJGKKCBILDDTEC-SQKGQWCESA-N

Smiles

O1C([C@@H]([C@@H]([C@@H]([C@@H]([C@@](C[C@@H](C([C@@H](CC(=C1C)C)O)=O)C)(O)C)O)O)C)C\C=C\O)=O