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Substance Name: Venustatriol
RN: 105880-10-2
InChIKey: IFHPYSVGNHWKDY-TXODIXIKSA-N

Note

  • A marine algae metabolite.

Molecular Weight

  • 605.646
 
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Names and Synonyms

Results Name

  • Venustatriol

Synonym

  • (+)-Venustatriol

Systematic Name

  • 2,5-Furandimethanol, alpha2-((3S)-3-((2R,4aR,6R,8aS)-6-((2S,5R)-5-bromotetrahydro-2,6,6-trimethyl-2H-pyran-2-yl)octahydro-8a-methylpyrano(3,2-b)pyran-2-yl)-3-hydroxybutyl)tetrahydro-alpha5,alpha5,2-trimethyl-, (alpha2R,2S,5R)-

Registry Numbers

CAS Registry Number

  • 105880-10-2

System Generated Number

  • 0105880102

Structure Descriptors

InChI

1S/C30H53BrO7/c1-25(2,33)21-13-17-28(6,36-21)20(32)12-15-27(5,34)22-9-10-23-29(7,37-22)18-14-24(35-23)30(8)16-11-19(31)26(3,4)38-30/h19-24,32-34H,9-18H2,1-8H3/t19-,20-,21-,22-,23-,24-,27+,28+,29+,30+/m1/s1

InChIKey

IFHPYSVGNHWKDY-TXODIXIKSA-N

Smiles

C1[C@@H](O[C@@]2([C@@H](C1)O[C@H](CC2)[C@@]1(CC[C@@H](Br)C(O1)(C)C)C)C)[C@@](C)(O)CC[C@H]([C@@]1(O[C@H](CC1)C(C)(C)O)C)O