Glycoside
...
GD152618

Name:
3a,9a,11a-trimethyl-1-[1-(5-methyl-3,4,5,6-tetrahydropyridin-2-yl)ethyl]-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-2-yl acetate

Formula:
C36H57O8N

Smiles:
CC(=O)OC1CC2(C)C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC2(C)C1C(C)C1=NCC(C)CC1

Aglycone:
CC(=O)OC1CC2(C)C3CC=C4CC(O)CCC4(C)C3CCC2(C)C1C(C)C1=NCC(C)CC1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 6
HBD: 4 FractionCSP3: 0.89
AlogP: 4.19 Num_rotatable_bonds: 6
MolWt: 631.85 Num_heavy_atoms: 45
TPSA: 138.04 NumAromaticRings: 0

Unique Aglycone
AD60754
Formula: C30H47O3N

Smiles:
CC(=O)OC1CC2(C)C3CC=C4CC(O)CCC4(C)C3CCC2(C)C1C(C)C1=NCC(C)CC1
HBA: 4 RingCount: 5
HBD: 1 FractionCSP3: 0.87
AlogP: 6.37 Num_rotatable_bonds: 3
MolWt: 469.71 Num_heavy_atoms: 34
TPSA: 58.89 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O