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Substance Name: Vasculyne
RN: 172520-40-0
InChIKey: RRHHTWHYSHWOAP-PIOODCMWSA-N

Note

  • Isolated from the marine sponge Cribrochalina vasculum.

Molecular Formula

  • C43-H74-O2

Molecular Weight

  • 623.056
 
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Names and Synonyms

Results Name

  • Vasculyne

Synonym

  • Vasculyne

Systematic Name

  • 4,39,?-Tritetracontatriene-1,42-diyne-3,40-diol, (3R,4E,39E,40R)-

Registry Numbers

CAS Registry Number

  • 172520-40-0

System Generated Number

  • 0172520400

Structure Descriptors

InChI

1S/C43H74O2/c1-3-39-43(45)41-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-42(44)4-2/h1-2,19,21,37,40-42,44-45H,5-18,20,22-36,38-39H2/b21-19+,40-37+,43-41+/t42-/m0/s1

InChIKey

RRHHTWHYSHWOAP-PIOODCMWSA-N

Smiles

C#C[C@@H](\C=C\CCCCCCC\C=C\CCCCCCCCCCCCCCCCCCCCCCCC\C=C(/CC#C)O)O