GD028449

Name:

MADAGASCARENSILIDE D

Formula:

C49H76O20

Smiles:

CO[C@H]1C[C@@H](O[C@@H]2[C@@H](C)O[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4CC[C@]5(C=O)[C@@H]6CC[C@]7(C)[C@H](C8=CC(=O)OC8)CC[C@@]7(O)[C@H]6CC[C@@]5(O)C4)C[C@H]3O)C[C@H]2OC)O[C@@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC12CCC3C(CCC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1

Sugarmoiety:

COC1CC(OC2C(O)CC(O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(CO)C(O)C(O)C2O)C(C)O1

Other Identifiers

• CHEMBL1644524
• CNP0079783

AD00229

Formula: C23H32O6

Smiles:

CC12CCC3C(CCC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1

HBA:	6	RingCount:	5
HBD:	3	FractionCSP3:	0.83
AlogP:	1.9	Num_rotatable_bonds:	2
MolWt:	404.5	Num_heavy_atoms:	29
TPSA:	104.06	NumAromaticRings:	0