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Substance Name: Biemnasterol
RN: 153229-20-0
InChIKey: IBFQWGIEQHTWFU-LYHJVHLQSA-N

Note

  • Isolated from the marine sponge Biemna.

Molecular Formula

  • C28-H44-O3

Molecular Weight

  • 428.653
 
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Names and Synonyms

Name of Substance

  • Biemnasterol

Synonym

  • (3beta,5alpha,6beta,22E,24R)-Ergosta-7,22,25-triene-3,5,6-triol

Systematic Name

  • Ergosta-7,22,25-triene-3,5,6-triol, (3beta,5alpha,6beta,22E,24R)-

Registry Numbers

CAS Registry Number

  • 153229-20-0

System Generated Number

  • 0153229200

Structure Descriptors

InChI

1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,18-20,22-25,29-31H,1,9-14,16H2,2-6H3/b8-7+/t18-,19-,20+,22-,23+,24+,25-,26-,27-,28+/m1/s1

InChIKey

IBFQWGIEQHTWFU-LYHJVHLQSA-N

Smiles

C1[C@H]2C3=C[C@H]([C@@]4(C[C@H](CC[C@@]4([C@H]3CC[C@@]2([C@H]([C@@H](\C=C\[C@H](C(C)=C)C)C)C1)C)C)O)O)O