Glycoside
...
GD002778

Name:
Spiramycin Ii

Formula:
C45H76O15N2

Smiles:
CO[C@H]1[C@H](OC(C)=O)CC(=O)O[C@@H](C)CC=CC=C[C@@H](O[C@@H]2CC[C@H](N(C)C)[C@H](C)O2)[C@@H](C)C[C@@H](CC=O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O[C@@H]2C[C@@](C)(O)[C@H](O)[C@H](C)O2)[C@H](N(C)C)[C@H]1O

Aglycone:
COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC(CC=O)C1O

Sugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 3 FractionCSP3: 0.84
AlogP: 2.9 Num_rotatable_bonds: 12
MolWt: 885.1 Num_heavy_atoms: 62
TPSA: 201.45 NumAromaticRings: 0

Unique Aglycone
AD02611
Formula: C30H49O9N

Smiles:
COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC(CC=O)C1O
HBA: 10 RingCount: 2
HBD: 1 FractionCSP3: 0.77
AlogP: 3.2 Num_rotatable_bonds: 7
MolWt: 567.72 Num_heavy_atoms: 40
TPSA: 120.83 NumAromaticRings: 0

Sugarmoiety
SD00067

CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1