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Substance Name: Xestobergsterol B
RN: 141272-44-8
InChIKey: DGXRPSIAVFYMOL-NFUSMCCKSA-N

Note

  • Isolated from the Okinawan marine sponge Xestospongia bergquistia.

Molecular Weight

  • 480.638
 
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Names and Synonyms

  • Xestobergsterol B

Registry Numbers

CAS Registry Number

  • 141272-44-8

System Generated Number

  • 0141272448

Structure Descriptors

InChI

1S/C27H44O7/c1-11(2)9-27(34)10-12(3)17-19(27)23(32)18-16-13(6-7-25(17,18)4)26(5)14(20(29)22(16)31)8-15(28)21(30)24(26)33/h11-22,24,28-31,33-34H,6-10H2,1-5H3/t12-,13?,14-,15+,16?,17+,18+,19-,20-,21-,22-,24-,25-,26-,27-/m1/s1

InChIKey

DGXRPSIAVFYMOL-NFUSMCCKSA-N

Smiles

C1([C@@H]2[C@](CC(C)C)(O)C[C@H]([C@@H]2[C@@]2(CC[C@@H]3[C@@H]([C@@H]12)[C@H]([C@@H]([C@@H]1[C@@]3([C@@H]([C@@H]([C@H](O)C1)O)O)C)O)O)C)C)=O