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Substance Name: Scalaradial
RN: 53527-28-9
InChIKey: ADWFEADZGIHPDE-QGERINELSA-N

Note

  • A marine natural product isolated from the sponge Cacospongia sp.

Molecular Formula

  • C27-H40-O4

Molecular Weight

  • 428.609
 
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Names and Synonyms

Name of Substance

  • Scalaradial

Synonym

  • CCRIS 1710

Systematic Names

  • 1,2-Chrysenedicarboxaldehyde, 12-(acetyloxy)-1,4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12,12a-hexadecahydro-4b,7,7,10a,12a-pentamethyl-, (1R,4aS,4bR,6aS,10aS,10bR,12S,12aS)-
  • Scalaradial

Registry Numbers

CAS Registry Number

  • 53527-28-9

System Generated Number

  • 0053527289

Structure Descriptors

InChI

1S/C27H40O4/c1-17(30)31-23-14-22-25(4)12-7-11-24(2,3)20(25)10-13-26(22,5)21-9-8-18(15-28)19(16-29)27(21,23)6/h8,15-16,19-23H,7,9-14H2,1-6H3/t19-,20-,21-,22+,23-,25-,26-,27+/m0/s1

InChIKey

ADWFEADZGIHPDE-QGERINELSA-N

Smiles

CC(=O)O[C@H]1C[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@@]2(C)[C@@H]4CC=C(C=O)[C@H](C=O)[C@@]14C