Glycoside
GD008609
Name:
NoneFormula:
C52H78O15N6Smiles:
CCCCCCCCCCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)[C@@H]1C(=O)N[C@H](C)C(=O)N[C@H](C(=O)O)Cc2ccc(O)c(c2)-c2cc1ccc2O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCCCCCCCC(=O)N(C)C(CO)C(=O)NC(C)C(=O)NCC(=O)N(C)C1C(=O)NC(C)C(=O)NC(C(=O)O)Cc2ccc(O)c(c2)-c2cc1ccc2OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.63 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 25 |
| MolWt: | 1027.22 | Num_heavy_atoms: | 73 |
| TPSA: | 313.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD06851
Formula: C46H68O11N6
Smiles:
CCCCCCCCCCCCCCCC(=O)N(C)C(CO)C(=O)NC(C)C(=O)NCC(=O)N(C)C1C(=O)NC(C)C(=O)NC(C(=O)O)Cc2ccc(O)c(c2)-c2cc1ccc2O| HBA: | 17 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.59 |
| AlogP: | 3.82 | Num_rotatable_bonds: | 23 |
| MolWt: | 881.08 | Num_heavy_atoms: | 63 |
| TPSA: | 255.01 | NumAromaticRings: | 2 |
