GD023455

Name:

None

Formula:

C54H82O14N4

Smiles:

CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@H](CCOC2NNC(c3ccccc3)C(c3ccccc3)N2)C[C@H](C)C(=O)C=CC(C)=C[C@H]1CO[C@@H]1O[C@H](C)[C@H](O)[C@H](OC)[C@H]1OC

Aglycone:

CCC1OC(=O)CC(O)C(C)C(O)C(CCOC2NNC(c3ccccc3)C(c3ccccc3)N2)CC(C)C(=O)C=CC(C)=CC1CO

Sugarmoiety:

CC1OC(O)C(O)C(N(C)C)C1O.COC1C(O)OC(C)C(O)C1OC

Other Identifiers

• CHEMBL264075

AD15769

Formula: C38H53O7N3

Smiles:

CCC1OC(=O)CC(O)C(C)C(O)C(CCOC2NNC(c3ccccc3)C(c3ccccc3)N2)CC(C)C(=O)C=CC(C)=CC1CO

HBA:	10	RingCount:	4
HBD:	6	FractionCSP3:	0.53
AlogP:	4.26	Num_rotatable_bonds:	8
MolWt:	663.86	Num_heavy_atoms:	48
TPSA:	149.38	NumAromaticRings:	2