LIPID MAPS

Structure Database (LMSD)

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Common Name

Pariposide E

Systematic Name

Stigmasta-5,22E-dien-3β-ol 3-O-β-D-glucopyranosyl-(1-6)-[β-D-glucopyranosyl-(112)]-β-D-glucopyranoside

Synonyms

LM ID

LMST01040279

Formula

C₄₇H₇₈O₁₆

Exact Mass

Calculate m/z

898.52899

Status

Active

Show lipids differing only in stereochemistry/bond geometry

No other lipid differing only in stereochemistry/bond geometry found

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Paris polyphylla var. yunnanensis (#221260)

Magnoliopsida (#3398)

Parisvaniosides A-E, five new steroidal saponins from Paris vaniotii,
Steroids, 2021

Pubmed ID: 34896125

String Representations

InChiKey (Click to copy)

YFZMUVCBXJEYAF-IRNBMRAHSA-N

InChi (Click to copy)

InChI=1S/C47H78O16/c1-7-24(22(2)3)9-8-23(4)28-12-13-29-27-11-10-25-18-26(14-16-46(25,5)30(27)15-17-47(28,29)6)59-45-42(63-44-41(57)38(54)35(51)32(20-49)61-44)39(55)36(52)33(62-45)21-58-43-40(56)37(53)34(50)31(19-48)60-43/h8-11,22-45,48-57H,7,12-21H2,1-6H3/b9-8+/t23-,24-,25?,26+,27?,28-,29+,30+,31-,32-,33-,34-,35-,36-,37+,38+,39+,40-,41-,42-,43-,44+,45-,46+,47-/m1/s1

SMILES (Click to copy)

C1[C@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)O2)CC2[C@@](C)([C@@]3([H])CC[C@]4(C)[C@@]([H])([C@@H](/C=C/[C@@H](CC)C(C)C)C)CC[C@@]4([H])C3C=C2)C1