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Substance Name: Nigranoic acid
RN: 39111-07-4
InChIKey: YITJRPBGPLTGRG-FBHDLOMBSA-N

Note

  • From stem of Schisandra sphaerandra.

Molecular Weight

  • 470.689
 
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Names and Synonyms

Results Name

  • Nigranoic acid

Synonym

  • Nigranoic acid

Systematic Name

  • 3,4-Secocycloarta-4(28),24-(Z)-diene-3,26-dioic acid

Registry Numbers

CAS Registry Number

  • 39111-07-4

System Generated Number

  • 0039111074

Structure Descriptors

InChI

1S/C30H46O4/c1-19(2)22-12-15-27(5)17-18-30-23(29(22,27)16-13-24(31)32)11-8-14-28(30,6)25(30)20(3)9-7-10-21(4)26(33)34/h10,20,22-23,25H,1,7-9,11-18H2,2-6H3,(H,31,32)(H,33,34)/b21-10-

InChIKey

YITJRPBGPLTGRG-FBHDLOMBSA-N

Smiles

C1[C@@]2([C@@]([C@@H]3CCC[C@@]4([C@@]3(C1)[C@@H]4[C@@H](CC\C=C(\C)C(=O)O)C)C)([C@@H](CC2)C(=C)C)CCC(=O)O)C