GD031213

Name:

None

Formula:

C43H74O14

Smiles:

C[C@@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3C[C@]4(C)[C@H](C[C@H](O)[C@@H]5[C@](C)([C@]6(C)CC[C@H](C(C)(C)O)O6)CC[C@]54C)[C@]4(C)CC[C@H](O)C(C)(C)[C@H]34)O[C@@H](CO)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC(C)(O)C1CCC(C)(C2(C)CCC3(C)C2C(O)CC2C4(C)CCC(O)C(C)(C)C4C(O)CC23C)O1

Sugarmoiety:

CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL3585574

AD20119

Formula: C31H54O5

Smiles:

CC(C)(O)C1CCC(C)(C2(C)CCC3(C)C2C(O)CC2C4(C)CCC(O)C(C)(C)C4C(O)CC23C)O1

HBA:	5	RingCount:	5
HBD:	4	FractionCSP3:	1.0
AlogP:	5.07	Num_rotatable_bonds:	2
MolWt:	506.77	Num_heavy_atoms:	36
TPSA:	90.15	NumAromaticRings:	0