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Substance Name: Phomasetin
RN: 207791-30-8
InChIKey: GQYNYOOJEMDNNZ-LWUDIGNESA-N

Molecular Formula

  • C25-H35-N-O4

Molecular Weight

  • 413.5545
 
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Names and Synonyms

Results Name

  • Phomasetin

Synonym

  • Phomasetin

Systematic Name

  • 2,4-Pyrrolidinedione, 5-(hydroxymethyl)-3-(hydroxy((1R,2S,4aR,6S,8aS)-1,2,4a,5,6,7,8,8a-octahydro-1,3,6-trimethyl-2-(1E,3E)-1,3-pentadienyl-1-naphthalenyl)methylene)-1-methyl-, (3E,5R)-

Registry Numbers

CAS Registry Number

  • 207791-30-8

System Generated Number

  • 0207791308

Structure Descriptors

InChI

1S/C25H35NO4/c1-6-7-8-9-18-16(3)13-17-12-15(2)10-11-19(17)25(18,4)23(29)21-22(28)20(14-27)26(5)24(21)30/h6-9,13,15,17-20,27,29H,10-12,14H2,1-5H3/b7-6+,9-8+,23-21+/t15-,17?,18-,19-,20+,25-/m0/s1

InChIKey

GQYNYOOJEMDNNZ-LWUDIGNESA-N

Smiles

C/C=C/C=C/[C@H]1C(=CC2C[C@H](CC[C@@H]2[C@@]1(C)/C(=C\3/C(=O)[C@H](N(C3=O)C)CO)/O)C)C