Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Symlandine
RN: 74410-74-5
InChIKey: MVWPTZQHBOWRTF-QKJMJVMDSA-N

Note

  • From the roots of common comfrey, Symphytum officinale (Boraginaceae).

Molecular Formula

  • C20-H31-N-O6

Molecular Weight

  • 381.4659
 
* 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

Name of Substance

  • Symlandine

Synonym

  • Symlandine

Systematic Name

  • 2-Butenoic acid, 2-methyl-, 7-((2,3-dihydroxy-2-(1-methylethyl)-1-oxobutoxy)methyl)-2,3,5,7a-tetrahydro-1H-pyrrolizin-1-yl ester, (1R-(1alpha(Z),7(2S*,3S*),7abeta))-

Registry Numbers

CAS Registry Number

  • 74410-74-5

System Generated Number

  • 0074410745

Structure Descriptors

InChI

1S/C20H31NO6/c1-6-13(4)18(23)27-16-8-10-21-9-7-15(17(16)21)11-26-19(24)20(25,12(2)3)14(5)22/h6-7,12,14,16-17,22,25H,8-11H2,1-5H3/b13-6-/t14-,16+,17+,20-/m0/s1

InChIKey

MVWPTZQHBOWRTF-QKJMJVMDSA-N

Smiles

C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)C)O