Glycoside
GD039007
Name:
[(2z,6e,10e,14z,18e,22z,26z)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] [(2s,3s,4s,5r)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl] hydrogen phosphateFormula:
C55H91O8PSmiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | 15.06 | Num_rotatable_bonds: | 33 |
| MolWt: | 911.3 | Num_heavy_atoms: | 64 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD24231
Formula: C50H83O4P
Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 16.6 | Num_rotatable_bonds: | 30 |
| MolWt: | 779.18 | Num_heavy_atoms: | 55 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
