GD144290

Name:

10-[(5-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl]oxy}-4-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-2-hydroxy-4,5,9,9,13,20-hexamethyl-22-oxahexacyclo[18.3.2.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]pentacos-16-en-21-one

Formula:

C52H82O22

Smiles:

CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(CO)C(O)C(O)C7OC7OCC(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC41C)C3C2

Aglycone:

CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC41C)C3C2

Sugarmoiety:

OCC1OC(OC2C(O)OCC(OC3OC(CO)C(O)C(O)C3OC3OCC(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0205372

AD08979

Formula: C30H46O4

Smiles:

CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC41C)C3C2

HBA:	4	RingCount:	7
HBD:	2	FractionCSP3:	0.9
AlogP:	5.66	Num_rotatable_bonds:	0
MolWt:	470.69	Num_heavy_atoms:	34
TPSA:	66.76	NumAromaticRings:	0