Glycoside

GD118944
Name:
Leucomycin A7Formula:
C38H63O14NSmiles:
CCC(=O)OC1C(C)OC(OC2C(C)OC(OC3C(CC=O)CC(C)C(O)C=CC=CCC(C)OC(=O)CC(O)C3OC)C(O)C2N(C)C)CC1(C)OAglycone:
CCC(=O)O.COC1C(O)CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1OSugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1Other Identifiers
Properties
HBA: | 15 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.82 |
AlogP: | 1.81 | Num_rotatable_bonds: | 10 |
MolWt: | 757.92 | Num_heavy_atoms: | 53 |
TPSA: | 199.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD00155
Formula: C3H6O2
Smiles:
CCC(=O)OHBA: | 2 | RingCount: | 0 |
HBD: | 1 | FractionCSP3: | 0.67 |
AlogP: | 0.48 | Num_rotatable_bonds: | 1 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 37.3 | NumAromaticRings: | 0 |
AD02434
Formula: C20H32O7
Smiles:
COC1C(O)CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1OHBA: | 7 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.7 |
AlogP: | 1.15 | Num_rotatable_bonds: | 3 |
MolWt: | 384.47 | Num_heavy_atoms: | 27 |
TPSA: | 113.29 | NumAromaticRings: | 0 |