Glycoside

GD149577
Name:
colletotrichamide dFormula:
C36H58O11N2Smiles:
CC(C)CC1C(=O)OC(C(C)CCCCC(C)OC2OC(CO)C(O)C(O)C2O)CC(O)C(C)C(O)=NC(Cc2ccccc2)C(=O)N1CAglycone:
CC(C)CC1C(=O)OC(C(C)CCCCC(C)O)CC(O)C(C)C(O)=NC(Cc2ccccc2)C(=O)N1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.75 |
AlogP: | 2.14 | Num_rotatable_bonds: | 13 |
MolWt: | 694.86 | Num_heavy_atoms: | 49 |
TPSA: | 198.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD59798
Formula: C30H48O6N2
Smiles:
CC(C)CC1C(=O)OC(C(C)CCCCC(C)O)CC(O)C(C)C(O)=NC(Cc2ccccc2)C(=O)N1CHBA: | 8 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.7 |
AlogP: | 4.32 | Num_rotatable_bonds: | 10 |
MolWt: | 532.72 | Num_heavy_atoms: | 38 |
TPSA: | 119.66 | NumAromaticRings: | 1 |