Glycoside
GD149872
Name:
Zgl1Formula:
C54H107O17N2PSmiles:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1N)C(O)C(O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCCSugarmoiety:
NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.98 |
| AlogP: | 6.81 | Num_rotatable_bonds: | 46 |
| MolWt: | 1087.42 | Num_heavy_atoms: | 74 |
| TPSA: | 335.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD51179
Formula: C48H96O13NP
Smiles:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC| HBA: | 14 | RingCount: | 1 |
| HBD: | 10 | FractionCSP3: | 0.98 |
| AlogP: | 9.02 | Num_rotatable_bonds: | 43 |
| MolWt: | 926.26 | Num_heavy_atoms: | 63 |
| TPSA: | 250.19 | NumAromaticRings: | 0 |
