Glycoside
GD037612
Name:
NoneFormula:
C59H108O19N6PSmiles:
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)O[C@H]([C@H](C=O)NC(C)=O)[C@H](O)[C@H](O)CO)C(N)=O)OC(=O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCCNC(=O)C(C)NC(=O)CCC(NC(=O)C(C)NC(=O)CC)C(N)=O)OC(=O)CCCCCCCCCCCCCCCSugarmoiety:
CC(=O)NC(C=O)C(OO)C(O)C(O)COOther Identifiers
Properties
| HBA: | 25 | RingCount: | 0 |
| HBD: | 10 | FractionCSP3: | 0.85 |
| AlogP: | 4.97 | Num_rotatable_bonds: | 56 |
| MolWt: | 1236.51 | Num_heavy_atoms: | 85 |
| TPSA: | 386.77 | NumAromaticRings: | 0 |
Unique Aglycone
AD23671
Formula: C51H95O13N5P
Smiles:
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCCNC(=O)C(C)NC(=O)CCC(NC(=O)C(C)NC(=O)CC)C(N)=O)OC(=O)CCCCCCCCCCCCCCC| HBA: | 18 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | 8.19 | Num_rotatable_bonds: | 48 |
| MolWt: | 1017.32 | Num_heavy_atoms: | 70 |
| TPSA: | 270.68 | NumAromaticRings: | 0 |
