Glycoside
GD120871
Name:
4-{3a,5a,11-trihydroxy-3b,9a,11a-trimethyl-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl}-2,5-dihydrofuran-2-oneFormula:
C30H46O10Smiles:
CC1OC(OC2CCC3(C)C4CC(O)C5(C)C(C6=CC(=O)OC6)CCC5(O)C4(C)CCC3(O)C2)C(O)C(O)C1OAglycone:
CC12CCC(O)CC1(O)CCC1(C)C2CC(O)C2(C)C(C3=CC(=O)OC3)CCC12OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.9 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 566.69 | Num_heavy_atoms: | 40 |
| TPSA: | 166.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD48598
Formula: C24H36O6
Smiles:
CC12CCC(O)CC1(O)CCC1(C)C2CC(O)C2(C)C(C3=CC(=O)OC3)CCC12O| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 2.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 420.55 | Num_heavy_atoms: | 30 |
| TPSA: | 107.22 | NumAromaticRings: | 0 |
