Glycoside
GD012244
Name:
NoneFormula:
C50H76O15Smiles:
CC[C@H](C)[C@@H]1O[C@@]2(C=C[C@H]1C)C[C@@H]1C[C@H](CC=C(C)[C@H](O[C@@H]3C[C@H](OC)[C@H](O[C@@H]4O[C@H](C)[C@H](OC)[C@H](OC)[C@H]4OC)[C@H](C)O3)[C@H](C)C=CC=C3CO[C@@H]4[C@H](O)C(C)=C[C@H](C(=O)O1)[C@]34O)O2Aglycone:
CCC(C)C1OC2(C=CC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(O)C(C)=CC(C(=O)O1)C34O)O2Sugarmoiety:
COC1CC(O)OC(C)C1OC1OC(C)C(OC)C(OC)C1OCOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | 5.66 | Num_rotatable_bonds: | 10 |
| MolWt: | 917.14 | Num_heavy_atoms: | 65 |
| TPSA: | 168.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD00521
Formula: C34H48O8
Smiles:
CCC(C)C1OC2(C=CC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(O)C(C)=CC(C(=O)O1)C34O)O2| HBA: | 8 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 4.31 | Num_rotatable_bonds: | 2 |
| MolWt: | 584.75 | Num_heavy_atoms: | 42 |
| TPSA: | 114.68 | NumAromaticRings: | 0 |
