LIPID MAPS

Structure Database (LMSD)

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Systematic Name

(24S)-methyl-3β,7α,12α-trihydroxy-cholest-5(6),9(11)-dien

Synonyms

Ergosta-5,9(11)-dien-3beta,7alpha,12alpha-triol

LM ID

LMST01031392

Formula

C₂₈H₄₆O₃

Exact Mass

Calculate m/z

430.344696

Sum Composition

ST 28:2;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)

ZTMHQYKLRNPUMQ-OXYUAQQLSA-N

InChi (Click to copy)

InChI=1S/C28H46O3/c1-16(2)17(3)7-8-18(4)21-9-10-22-26-23(15-25(31)28(21,22)6)27(5)12-11-20(29)13-19(27)14-24(26)30/h14-18,20-22,24-26,29-31H,7-13H2,1-6H3/t17-,18+,20-,21+,22-,24+,25-,26-,27-,28+/m0/s1

SMILES (Click to copy)

[C@]12([C@H](O)C=C3C[C@@H](O)CC[C@]3(C)C1=C[C@H](O)[C@]1(C)[C@@]([H])([C@@](C)([H])CC[C@H](C)C(C)C)CC[C@@]21[H])[H]