GD136574

Name:

15'-[(5-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-7'-hydroxy-8',12'-dimethyl-6'-oxaspiro[oxolane-3,5'-pentacyclo[9.8.0.0¹,⁷.0⁴,⁸.0¹²,¹⁷]nonadecan]-5-one

Formula:

C42H66O19

Smiles:

COC1C(O)C(OC2CCC3(C)C(CCC45CCC6C7(COC(=O)C7)OC4(O)C6(C)CCC35)C2)OC(C)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O

Aglycone:

CC12CCC(O)CC1CCC13CCC4C5(COC(=O)C5)OC1(O)C4(C)CCC23

Sugarmoiety:

COC1C(O)C(O)OC(C)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O

Other Identifiers

• CNP0314940

AD55210

Formula: C23H34O5

Smiles:

CC12CCC(O)CC1CCC13CCC4C5(COC(=O)C5)OC1(O)C4(C)CCC23

HBA:	5	RingCount:	6
HBD:	2	FractionCSP3:	0.96
AlogP:	3.16	Num_rotatable_bonds:	0
MolWt:	390.52	Num_heavy_atoms:	28
TPSA:	75.99	NumAromaticRings:	0