LIPID MAPS

Structure Database (LMSD)

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Common Name

Linckoside A

Systematic Name

(24R)-3-O-(2-O-methyl-β-D-xylopyranosyl)-29-O-(α-arabinofuranosyl)-stigmasta-4-ene-3β,6β,8,15α,16β,28-hexaol

Synonyms

LM ID

LMST05050047

Formula

C₄₀H₆₈O₁₄

Exact Mass

Calculate m/z

772.46091

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Linckia laevigata (#109185)

Asteroidea (#7588)

Two new polyhydroxylated steroidal glycosides from the starfish Culcita novaeguineae,
J Nat Prod, 2020

Pubmed ID: 33336584

String Representations

InChiKey (Click to copy)

PELCRPYRGYHBOK-VNVJSXGOSA-N

InChi (Click to copy)

InChI=1S/C40H68O14/c1-19(2)21(11-14-51-36-33(48)30(45)26(17-41)54-36)8-7-20(3)28-31(46)32(47)35-39(28,5)13-10-27-38(4)12-9-22(15-23(38)24(42)16-40(27,35)49)53-37-34(50-6)29(44)25(43)18-52-37/h15,19-22,24-37,41-49H,7-14,16-18H2,1-6H3/t20-,21-,22+,24-,25-,26+,27-,28+,29+,30+,31-,32+,33-,34-,35-,36-,37+,38+,39-,40+/m1/s1

SMILES (Click to copy)

C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CC[C@H](CCO[C@H]5[C@H](O)[C@@H](O)[C@H](CO)O5)C(C)C)[C@@H](O)[C@H](O)[C@@]4([H])[C@]3(O)C[C@@H](O)C2=C[C@@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2OC)C1