Glycoside
GD127996
Name:
Eurocidin DFormula:
C40H61O15NSmiles:
CCC(C)C1CC=CC=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)C(O)CCC(=O)CC(O)CC(=O)O1)CC(O)C2C(=O)OAglycone:
CCC(C)C1CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)C(O)CCC(=O)CC(O)CC(=O)O1)CC(O)C2C(=O)OSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.68 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 5 |
| MolWt: | 795.92 | Num_heavy_atoms: | 56 |
| TPSA: | 275.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD51851
Formula: C34H50O12
Smiles:
CCC(C)C1CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)C(O)CCC(=O)CC(O)CC(=O)O1)CC(O)C2C(=O)O| HBA: | 12 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 650.76 | Num_heavy_atoms: | 46 |
| TPSA: | 211.28 | NumAromaticRings: | 0 |
