Glycoside

GD014183
Name:
IRCINIALACTAM DFormula:
C29H45O9NSmiles:
CCOC(=O)C(O)(C[C@H](C)CCCC(C)=CCCC(C)=CCCC1=CCN(CC(=O)O)C1=O)C(C)(O)C(=O)OAglycone:
CC(=CCCC1=CCN(CC(=O)O)C1=O)CCC=C(C)CCCC(C)CSugarmoiety:
CCOC(=O)C(O)(O)C(C)(O)C(=O)OOther Identifiers
Properties
HBA: | 10 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.66 |
AlogP: | 3.62 | Num_rotatable_bonds: | 18 |
MolWt: | 551.68 | Num_heavy_atoms: | 39 |
TPSA: | 161.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD10469
Formula: C22H35O3N
Smiles:
CC(=CCCC1=CCN(CC(=O)O)C1=O)CCC=C(C)CCCC(C)CHBA: | 4 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.64 |
AlogP: | 5.12 | Num_rotatable_bonds: | 12 |
MolWt: | 361.53 | Num_heavy_atoms: | 26 |
TPSA: | 57.61 | NumAromaticRings: | 0 |