GD012621

Name:

Hupeheninoside

Formula:

C33H55O7N

Smiles:

C[C@@H]1CC[C@@H]2[C@H](C)[C@@H]3CC[C@@H]4[C@@H]5C[C@H](O)[C@@H]6C[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)CC[C@@]6(C)[C@H]5C[C@H]4[C@H]3CN2C1

Aglycone:

CC1CCC2C(C)C3CCC4C(CC5C4CC(O)C4CC(O)CCC45C)C3CN2C1

Sugarmoiety:

OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4125795
• CHEMBL4127029
• CNP0192764

AD09498

Formula: C27H45O2N

Smiles:

CC1CCC2C(C)C3CCC4C(CC5C4CC(O)C4CC(O)CCC45C)C3CN2C1

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	1.0
AlogP:	4.56	Num_rotatable_bonds:	0
MolWt:	415.66	Num_heavy_atoms:	30
TPSA:	43.7	NumAromaticRings:	0