LIPID MAPS

Structure Database (LMSD)

Download as... MDLMOL SDF CSV TSV PNG SVG

Systematic Name

3β,5α,12α-trihydroxy-cholest-6(7),9(11),24(28)-trien

Synonyms

24-methylene-cholest-6,9(11)-dien-3beta,5alpha,12alpha-triol

LM ID

LMST01031390

Formula

C₂₈H₄₄O₃

Exact Mass

Calculate m/z

428.329046

Sum Composition

ST 28:3;O3

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Sclerophytum (#3122587)

Anthozoa (#6101)

Discovery of undescribed steroids with anti-inflammatory and anti-hepatic fibrosis activities from the Formosan soft coral Sclerophytum leptoclados.,
RSC Adv, 2026

Pubmed ID: 42524205

DOI: 10.1039/d6ra01151a

String Representations

InChiKey (Click to copy)

XVWBGLOVLXVJBU-BWVRBOCWSA-N

InChi (Click to copy)

InChI=1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-12-14-28(31)16-20(29)11-13-26(28,5)24(21)15-25(30)27(22,23)6/h12,14-15,17,19-23,25,29-31H,3,7-11,13,16H2,1-2,4-6H3/t19-,20+,21+,22-,23+,25+,26-,27-,28-/m1/s1

SMILES (Click to copy)

[C@]12(C=C[C@@]3(O)C[C@@H](O)CC[C@]3(C)C1=C[C@H](O)[C@]1(C)[C@@]([H])([C@@](C)([H])CCC(=C)C(C)C)CC[C@@]21[H])[H]