GD142665

Name:

2-[(2-{[4,5-dihydroxy-6-({2-hydroxy-4,5,9,9,13,20,20-heptamethyl-23-methylidene-24-oxahexacyclo[15.5.2.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracosan-10-yl}oxy)oxan-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

Formula:

C48H78O16

Smiles:

C=C1OC23CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(O)C(O)C7OC7OC(C)C(O)C(O)C7O)C(O)C6O)C(C)(C)C5CCC4(C)C2(C)CC(O)C12CCC(C)(C)CC23

Aglycone:

C=C1OC23CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC(O)C12CCC(C)(C)CC23

Sugarmoiety:

CC1OC(OC2C(OC3COC(O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0421607

AD48883

Formula: C31H50O3

Smiles:

C=C1OC23CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC(O)C12CCC(C)(C)CC23

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	0.94
AlogP:	6.87	Num_rotatable_bonds:	0
MolWt:	470.74	Num_heavy_atoms:	34
TPSA:	49.69	NumAromaticRings:	0