Secondary metabolite: Demalonyl fomitopsin H



Demalonyl fomitopsin H
Summary
Molecular formula: C32H50O5
SMILES: C[C@@H]1CC2(OCC(=O)[C@H]([C@@H]2C)C)OC[C@]23[C@@H]1CC[C@@]3(C)C1=C(C[C@H]2O)[C@@]2(C)CC[C@H](C(C2CC1)(C)C)O
InChI: InChI=1S/C32H50O5/c1-18-15-32(20(3)19(2)24(33)16-36-32)37-17-31-21(18)10-13-30(31,7)22-8-9-25-28(4,5)26(34)11-12-29(25,6)23(22)14-27(31)35/h18-21,25-27,34-35H,8-17H2,1-7H3/t18-,19+,20+,21-,25?,26-,27-,29-,30+,31+,32?/m1/s1
InChIKey: AXHOBTFZUYASHN-JDVSLVPVSA-N
Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CCC2(CCC3CCC4C5=C(CCC34CO2)C2CCCCC2CC5)OC1

Scaffold Graph/Node level:
OC1CCC2(CCC3CCC4C5CCC6CCCCC6C5CCC34CO2)OC1

Scaffold Graph level:
CC1CCC2(CC1)CCC1CCC3C4CCC5CCCCC5C4CCC13CC2
Chemical classification
Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Triterpenoids
Synonymous chemical names:
demalonyl fomitopsin h
Chemical structure download

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