LIPID MAPS

Structure Database (LMSD)

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Common Name

Gypenoside S2

Systematic Name

3β,20S,21-trihydroxy-25-methoxydammar-23-ene-12-one-3-O-{[α-l-rhamnopyranosyl(1-2)]-[β-d-xylopyranosyl(1-3)]-α-l-arabinopyranosyl}-21-O-β-d-glucopyranoside

Synonyms

LM ID

LMPR0106080007

Formula

C₅₃H₈₈O₂₂

Exact Mass

Calculate m/z

1076.576732

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Gynostemma pentaphyllum (#182084)

Magnoliopsida (#3398)

Protective effects of four new saponins from Gynostemma pentaphyllum against hydrogen peroxide-induced neurotoxicity in SH-SY5Y cells.,
Bioorg Chem, 2020

Pubmed ID: 33213892

String Representations

InChiKey (Click to copy)

LZVHXQPFPKIRNH-RBQSPAAFSA-N

InChi (Click to copy)

InChI=1S/C53H88O22/c1-24-34(58)37(61)41(65)46(71-24)75-43-42(74-44-39(63)35(59)27(56)21-68-44)28(57)22-69-47(43)73-32-13-16-50(6)30(49(32,4)5)12-18-51(7)31(50)19-26(55)33-25(11-17-52(33,51)8)53(66,15-10-14-48(2,3)67-9)23-70-45-40(64)38(62)36(60)29(20-54)72-45/h10,14,24-25,27-47,54,56-66H,11-13,15-23H2,1-9H3/b14-10+/t24-,25-,27+,28-,29+,30-,31+,32-,33-,34-,35-,36+,37+,38-,39+,40+,41+,42-,43+,44-,45+,46-,47-,50-,51+,52+,53+/m0/s1

SMILES (Click to copy)

C1C[C@]2(C)[C@@]3([H])CC(=O)[C@]4([H])[C@@]([H])([C@@](CO[C@H]5[C@H](O)[C@@H](O)[C@@H]([C@@H](CO)O5)O)(O)C/C=C/C(OC)(C)C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O[C@@H]1OC[C@H](O)[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)[C@H]1O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O1