Glycoside

GD155957
Name:
Altromycin CFormula:
C46H57O17NSmiles:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)(C(=O)OC)C4CC(OC)C(O)C(C)O4)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1OC1CC(OC)C(O)C(C)O1Aglycone:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)(C(=O)OC)C4CC(OC)C(O)C(C)O4)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1OSugarmoiety:
COC1CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 18 | RingCount: | 8 |
HBD: | 5 | FractionCSP3: | 0.61 |
AlogP: | 2.55 | Num_rotatable_bonds: | 10 |
MolWt: | 895.95 | Num_heavy_atoms: | 64 |
TPSA: | 251.51 | NumAromaticRings: | 3 |
Unique Aglycone
AD61802
Formula: C39H45O14N
Smiles:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)(C(=O)OC)C4CC(OC)C(O)C(C)O4)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1OHBA: | 15 | RingCount: | 7 |
HBD: | 5 | FractionCSP3: | 0.54 |
AlogP: | 2.01 | Num_rotatable_bonds: | 7 |
MolWt: | 751.78 | Num_heavy_atoms: | 54 |
TPSA: | 223.82 | NumAromaticRings: | 3 |