GD029497

Name:

Torvoside P

Formula:

C44H72O17

Smiles:

CC1=C(CC[C@H](C)CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)O[C@@H]2C[C@@H]3[C@@H]4C[C@H](O[C@@H]5O[C@H](C)[C@H](O)[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@@H]5C[C@H](O)CC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@H]12

Aglycone:

CC1=C(CCC(C)CO)OC2CC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C12

Sugarmoiety:

CC1OC(O)C(O)C(OC2OCC(O)C(O)C2O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL3329791
• CNP0306200

AD19182

Formula: C27H44O4

Smiles:

CC1=C(CCC(C)CO)OC2CC3C4CC(O)C5CC(O)CCC5(C)C4CCC3(C)C12

HBA:	4	RingCount:	5
HBD:	3	FractionCSP3:	0.93
AlogP:	4.67	Num_rotatable_bonds:	4
MolWt:	432.65	Num_heavy_atoms:	31
TPSA:	69.92	NumAromaticRings:	0