Glycoside
GD116297
Name:
NoneFormula:
C65H125O20NSmiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)C(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(C)C(O)C(O)C2O)C1O)C(O)C(O)CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCCSugarmoiety:
CC1OC(OC2C(O)C(O)OC(CO)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 0.98 |
| AlogP: | 7.11 | Num_rotatable_bonds: | 52 |
| MolWt: | 1240.7 | Num_heavy_atoms: | 86 |
| TPSA: | 350.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD46087
Formula: C47H95O6N
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(O)C(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCC| HBA: | 7 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.98 |
| AlogP: | 12.61 | Num_rotatable_bonds: | 44 |
| MolWt: | 770.28 | Num_heavy_atoms: | 54 |
| TPSA: | 133.74 | NumAromaticRings: | 0 |
