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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

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

CC(C)C[C@@]1(O)C[C@@H](C)[C@H]2[C@@H]1C(=O)[C@@H]3C4[C@@H](O)[C@H](O)[C@H]5C[C@H](O)[C@@H](O)[C@@H](O)[C@]5(C)C4CC[C@]23C