Glycoside
...
GD003138

Name:
None

Formula:
C39H49O16N

Smiles:
COC(=O)C1c2cc3c(cc2C(OC2OC(C)C(OC)C(C)(OC)C2OC)CC1(C)O)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C([N+](C)(C)[O-])C1O

Aglycone:
COC(=O)C1c2cc3c(cc2C(O)CC1(C)O)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C([N+](C)(C)[O-])C1O

Sugarmoiety:
COC1C(C)OC(O)C(OC)C1(C)OC

Other Identifiers

Properties
HBA: 17 RingCount: 7
HBD: 4 FractionCSP3: 0.62
AlogP: 1.45 Num_rotatable_bonds: 7
MolWt: 787.81 Num_heavy_atoms: 56
TPSA: 229.03 NumAromaticRings: 2

Unique Aglycone
AD02883
Formula: C29H31O12N

Smiles:
COC(=O)C1c2cc3c(cc2C(O)CC1(C)O)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C([N+](C)(C)[O-])C1O
HBA: 13 RingCount: 6
HBD: 5 FractionCSP3: 0.48
AlogP: 0.24 Num_rotatable_bonds: 2
MolWt: 585.56 Num_heavy_atoms: 42
TPSA: 203.11 NumAromaticRings: 2

Sugarmoiety
SD00420

COC1C(C)OC(O)C(OC)C1(C)OC