Glycoside
GD139510
Name:
{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}({hydroxy[(3,7,11-trimethyldodeca-6,10-dien-1-yl)oxy]phosphoryl}oxy)phosphinic acidFormula:
C23H43O12NP2Smiles:
CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)OC1OC(CO)C(O)C(O)C1N=C(C)OAglycone:
CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)OSugarmoiety:
CC(O)=NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | 3.52 | Num_rotatable_bonds: | 16 |
| MolWt: | 587.54 | Num_heavy_atoms: | 38 |
| TPSA: | 204.8 | NumAromaticRings: | 0 |
Unique Aglycone
AD56252
Formula: C15H30O7P2
Smiles:
CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)O| HBA: | 7 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.73 |
| AlogP: | 4.71 | Num_rotatable_bonds: | 12 |
| MolWt: | 384.35 | Num_heavy_atoms: | 24 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
