GD013718

Name:

ILEKUDINOSIDE G

Formula:

C53H84O22

Smiles:

C[C@@H]1O[C@H](O[C@@H]2[C@H](O[C@@H]3CC[C@]4(C)[C@H](CC[C@]5(C)[C@H]4CC=C4[C@H]6[C@@]7(CC[C@](C)(OC7=O)[C@]6(C)O)CC[C@]45C)C3(C)C)OC[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC1(C)C(O)CCC2(C)C1CCC1(C)C2CC=C2C3C4(CCC(C)(OC4=O)C3(C)O)CCC21C

Sugarmoiety:

CC1OC(OC2C(O)OCC(O)C2OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL510110
• CNP0294973

AD10189

Formula: C30H46O4

Smiles:

CC1(C)C(O)CCC2(C)C1CCC1(C)C2CC=C2C3C4(CCC(C)(OC4=O)C3(C)O)CCC21C

HBA:	4	RingCount:	7
HBD:	2	FractionCSP3:	0.9
AlogP:	5.8	Num_rotatable_bonds:	0
MolWt:	470.69	Num_heavy_atoms:	34
TPSA:	66.76	NumAromaticRings:	0