Glycoside
GD148245
Name:
mfth2-mmft-1Formula:
C33H51O18NSmiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(Oc4ccc(CC5NC(O)=C(O)C5(C)C)cc4)C(O)C3O)C(OC)C2O)C(O)C1OAglycone:
CC1(C)C(O)=C(O)NC1Cc1ccc(O)cc1Sugarmoiety:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(OC)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 5 |
| HBD: | 11 | FractionCSP3: | 0.76 |
| AlogP: | -3.35 | Num_rotatable_bonds: | 13 |
| MolWt: | 749.76 | Num_heavy_atoms: | 52 |
| TPSA: | 288.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD45068
Formula: C13H17O3N
Smiles:
CC1(C)C(O)=C(O)NC1Cc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 2 |
| MolWt: | 235.28 | Num_heavy_atoms: | 17 |
| TPSA: | 72.72 | NumAromaticRings: | 1 |
