GD124189

Name:

2-({2-[(15-{2,5-dihydroxy-6-methyl-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]heptan-2-yl}-14-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:

C48H82O19

Smiles:

CC1OC(OC(C)(C)C(O)CCC(C)(O)C2C(O)CC3(C)C4CCC5C(C)(C)C(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)CCC56CC46CCC23C)C(O)C(O)C1O

Aglycone:

CC(C)(O)C(O)CCC(C)(O)C1C(O)CC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C

Sugarmoiety:

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

Other Identifiers

• CNP0144270

AD44865

Formula: C30H52O5

Smiles:

CC(C)(O)C(O)CCC(C)(O)C1C(O)CC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C

HBA:	5	RingCount:	5
HBD:	5	FractionCSP3:	1.0
AlogP:	4.42	Num_rotatable_bonds:	5
MolWt:	492.74	Num_heavy_atoms:	35
TPSA:	101.15	NumAromaticRings:	0