LIPID MAPS

Structure Database (LMSD)

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Common Name

Trillfurostanoside C

Systematic Name

26-O-β-D-glucopyranosyl-(25R)-furosta-16,22-dione-3β,5α,6β,26-tetrahydroxy-3-O-α-l-rhamnopyranosyl-(1-4)-α-l-rhamnopyranosyl-(1-4)-[α-l-rhamnopyranosyl-(1-2)]-β-D-glucopyranoside

Synonyms

3-O-(Rhaa1-4Rhaa1-4(Rhaa1-2)Glcb)-(25R)-furosta-26,22-dione-3beta,5alpha,6beta,26-tetrol

LM ID

LMST01070021

Formula

C₅₇H₉₄O₂₈

Exact Mass

Calculate m/z

1226.59317

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Trillium tschonoskii (#82502)

Magnoliopsida (#3398)

Furostanol Saponins from Trillium tschonoskii Promote the Expansion of Human Cord Blood Hematopoietic Stem and Progenitor Cells.,
J Nat Prod, 2020

Pubmed ID: 32870000

String Representations

InChiKey (Click to copy)

VHSPXOOZJFAPHJ-OVUKXJHCSA-N

InChi (Click to copy)

InChI=1S/C57H94O28/c1-20(19-76-50-42(70)40(68)37(65)31(17-58)81-50)8-9-29(60)21(2)34-30(61)15-28-26-14-33(62)57(75)16-25(10-13-56(57,7)27(26)11-12-55(28,34)6)80-54-49(85-52-44(72)39(67)36(64)23(4)78-52)46(74)48(32(18-59)82-54)84-53-45(73)41(69)47(24(5)79-53)83-51-43(71)38(66)35(63)22(3)77-51/h20-28,31-54,58-59,62-75H,8-19H2,1-7H3/t20-,21-,22+,23+,24+,25+,26-,27+,28+,31-,32-,33-,34+,35+,36+,37-,38-,39-,40+,41+,42-,43-,44-,45-,46+,47+,48-,49-,50-,51+,52+,53+,54-,55+,56-,57+/m1/s1

SMILES (Click to copy)

[C@]12(C[C@@H](O)[C@@]3(O)C[C@@H](O[C@H]4[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](O)[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O[C@H]6[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O6)[C@H](C)O5)[C@@H](CO)O4)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H]([C@@H](C(CC[C@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C)=O)C)C(=O)C[C@@]21[H])[H]