GD019385

Name:

ACODONTASTEROSIDE E

Formula:

C39H66O14

Smiles:

CO[C@@H]1[C@H](O[C@H]2[C@H](OC[C@H](C)[C@H](C)C=C[C@H](C)[C@@H]3C[C@H](O)[C@H]4[C@@]3(C)CC[C@H]3[C@@]4(O)C[C@H](O)[C@@H]4[C@H](O)[C@H](O)CC[C@]43C)OC[C@@H](O)[C@H]2O)OC[C@H](O)[C@H]1O

Aglycone:

CC(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(O)CC12O)C(C)CO

Sugarmoiety:

COC1C(OC2C(O)OCC(O)C2O)OCC(O)C1O

Other Identifiers

• CHEMBL450841
• CNP0167300

AD04735

Formula: C28H48O6

Smiles:

CC(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(O)CC12O)C(C)CO

HBA:	6	RingCount:	4
HBD:	6	FractionCSP3:	0.93
AlogP:	2.49	Num_rotatable_bonds:	5
MolWt:	480.69	Num_heavy_atoms:	34
TPSA:	121.38	NumAromaticRings:	0