Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Withafastuosin E
RN: 160954-07-4
InChIKey: UCOUIXCKSZUAKU-PYTKAWJLSA-N

Note

  • A withanolide from Datura fastuosa.

Molecular Formula

  • C28-H40-O7

Molecular Weight

  • 488.617
 
* 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

  • Withafastuosin E

Synonym

  • NSC 682346

Systematic Name

  • 5,6,21-Trihydroxy-20-(5-(hydroxymethyl)-4-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)pregn-2-en-1-one

Registry Numbers

CAS Registry Number

  • 160954-07-4

System Generated Number

  • 0160954074

Structure Descriptors

InChI

1S/C28H40O7/c1-15-11-22(35-25(33)17(15)13-29)18(14-30)20-7-6-19-16-12-24(32)28(34)9-4-5-23(31)27(28,3)21(16)8-10-26(19,20)2/h4-5,16,18-22,24,29-30,32,34H,6-14H2,1-3H3/t16-,18-,19?,20+,21-,22+,24+,26-,27-,28-/m0/s1

InChIKey

UCOUIXCKSZUAKU-PYTKAWJLSA-N

Smiles

C1(=C(C[C@@H](OC1=O)[C@@H]([C@@H]1[C@@]2(CC[C@@H]3[C@@]4([C@@]([C@@H](C[C@@H]3[C@@H]2CC1)O)(O)CC=CC4=O)C)C)CO)C)CO