Secondary metabolite: Erinacol



Erinacol
Summary
Molecular formula: C20H32O
SMILES: CC1=C[C@H](O)[C@]2([C@H](CC1)C1=C(CC[C@@]1(CC2)C)C(C)C)C
InChI: InChI=1S/C20H32O/c1-13(2)15-8-9-19(4)10-11-20(5)16(18(15)19)7-6-14(3)12-17(20)21/h12-13,16-17,21H,6-11H2,1-5H3/t16-,17+,19-,20-/m1/s1
InChIKey: ZTGGPQBJLZKPHO-PIKOESSRSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCC2CCC3CCC=C3C2CC1

Scaffold Graph/Node level:
C1CCC2CCC3CCCC3C2CC1

Scaffold Graph level:
C1CCC2CCC3CCCC3C2CC1
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Diterpenoids
Synonymous chemical names:
erinacol
External chemical identifiers:
CID_101348970; NPATLAS_NPA007542; CHEMSPIDER_28282186
Chemical structure download

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