GD115078

Name:

ahdp-mft-6

Formula:

C62H100O42N2

Smiles:

COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(Oc9ccc(CC%10N=C(O)C(N)C%10(C)C)cc9)C(O)C8O)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Aglycone:

CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N

Sugarmoiety:

COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(O)C(O)C8O)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

• CNP0437812

AD44967

Formula: C13H18O2N2

Smiles:

CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N

HBA:	4	RingCount:	2
HBD:	4	FractionCSP3:	0.46
AlogP:	1.63	Num_rotatable_bonds:	2
MolWt:	234.3	Num_heavy_atoms:	17
TPSA:	78.84	NumAromaticRings:	1