Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Trigonelloside B
RN: 60478-70-8
InChIKey: HSSJYSJXBOCKQM-SXJRTGLJSA-N

Molecular Weight

  • 1063.23
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Trigonelloside B

Synonyms

  • Methylprotoneodioscin
  • NSC 698791
  • Trigonelloside B

Registry Numbers

CAS Registry Number

  • 60478-70-8

System Generated Number

  • 0060478708

Structure Descriptors

InChI

1S/C52H86O22/c1-21(20-66-46-40(61)39(60)36(57)31(18-53)70-46)10-15-52(65-7)22(2)33-30(74-52)17-29-27-9-8-25-16-26(11-13-50(25,5)28(27)12-14-51(29,33)6)69-49-45(73-48-42(63)38(59)35(56)24(4)68-48)43(64)44(32(19-54)71-49)72-47-41(62)37(58)34(55)23(3)67-47/h8,21-24,26-49,53-64H,9-20H2,1-7H3/t21-,22-,23-,24-,26-,27+,28-,29?,30-,31+,32+,33-,34-,35-,36+,37+,38+,39-,40+,41+,42+,43-,44+,45+,46+,47-,48-,49+,50-,51-,52+/m0/s1

InChIKey

HSSJYSJXBOCKQM-SXJRTGLJSA-N

Smiles

O1[C@@H](C)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1[C@H](O[C@H]2CC[C@]3(C)[C@H]4CC[C@@]5([C@@H]6[C@H](C[C@@H]5[C@@H]4CC=C3C2)O[C@]([C@H]6C)(OC)CC[C@@H](CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C)C)O[C@H](CO)[C@H](O[C@@H]2O[C@H]([C@@H]([C@H]([C@H]2O)O)O)C)[C@@H]1O