GD011158

Name:

Torvoside A

Formula:

C45H76O18

Smiles:

C[C@H](CCC1(O)OC2CC3C4C[C@H](O[C@@H]5O[C@H](C)[C@H](O)[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@@H]5CC(O)CC[C@@]5(C)C4CC[C@@]3(C)C2[C@H]1C)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC(CO)CCC1(O)OC2CC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C2C1C

Sugarmoiety:

CC1OC(OC2C(O)C(C)OC(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4172482
• CNP0209913

AD02129

Formula: C27H46O5

Smiles:

CC(CO)CCC1(O)OC2CC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C2C1C

HBA:	5	RingCount:	5
HBD:	4	FractionCSP3:	1.0
AlogP:	3.72	Num_rotatable_bonds:	4
MolWt:	450.66	Num_heavy_atoms:	32
TPSA:	90.15	NumAromaticRings:	0