Glycoside
GD123359
Name:
Temnoside AFormula:
C49H97O9NSmiles:
CCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)CCCCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)CCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.98 |
| AlogP: | 10.93 | Num_rotatable_bonds: | 43 |
| MolWt: | 844.31 | Num_heavy_atoms: | 59 |
| TPSA: | 172.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD49776
Formula: C43H87O4N
Smiles:
CCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)CCCCCCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.98 |
| AlogP: | 13.11 | Num_rotatable_bonds: | 40 |
| MolWt: | 682.17 | Num_heavy_atoms: | 48 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
