GD134380

Name:

2-{[6-(6-{[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl)-5-hydroxy-2-methylhept-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:

C48H80O18

Smiles:

CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(CO)C(OC5OC(CO)C(OC6OC(C)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)COC1OC(CO)C(O)C(O)C1O

Aglycone:

CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(CO)C(O)CCC45CC35CCC12C)CO

Sugarmoiety:

CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CNP0162020

AD54367

Formula: C30H50O4

Smiles:

CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(CO)C(O)CCC45CC35CCC12C)CO

HBA:	4	RingCount:	5
HBD:	4	FractionCSP3:	0.93
AlogP:	5.08	Num_rotatable_bonds:	6
MolWt:	474.73	Num_heavy_atoms:	34
TPSA:	80.92	NumAromaticRings:	0