Secondary metabolite: Ergosta-2,5,7,9(11),22-pentaene



Ergosta-2,5,7,9(11),22-pentaene
Summary
Molecular formula: C28H40
SMILES: CC(C(C)C)/C=C/C(C1CCC2C1(C)CC=C1C2=CC=C2C1(C)CC=CC2)C
InChI: InChI=1S/C28H40/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h7-8,10-13,16,19-21,24-25H,9,14-15,17-18H2,1-6H3/b11-10+
InChIKey: PFZKLVBHMXVKAA-ZHACJKMWSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCC2C(=CC=C3C2=CCC2CCCC32)C1

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCC3CCC21
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Ergostane steroids
Synonymous chemical names:
ergosta-2,5,7,9(11),22-pentaene
Chemical structure download

Designed by R.P. Vivek-Ananth, M Karthikeyan and Ajaya Kumar Sahoo