Glycoside
GD017563
Name:
NoneFormula:
C43H78O12Smiles:
CCCCCC[C@H](O)CCC[C@H](OC[C@@H]1O[C@H](O)[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC[C@H]([C@@H]2CC[C@H]([C@H](O)CCCCCCCCCCCCC3C[C@H](C)OC3=O)O2)O1Aglycone:
CCCCCCC(O)CCCC(OC)C1CCC(C2CCC(C(O)CCCCCCCCCCCCC3CC(C)OC3=O)O2)O1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.98 |
| AlogP: | 5.76 | Num_rotatable_bonds: | 28 |
| MolWt: | 787.08 | Num_heavy_atoms: | 55 |
| TPSA: | 184.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD12518
Formula: C38H70O7
Smiles:
CCCCCCC(O)CCCC(OC)C1CCC(C2CCC(C(O)CCCCCCCCCCCCC3CC(C)OC3=O)O2)O1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.97 |
| AlogP: | 8.59 | Num_rotatable_bonds: | 26 |
| MolWt: | 638.97 | Num_heavy_atoms: | 45 |
| TPSA: | 94.45 | NumAromaticRings: | 0 |
