Glycoside
GD123769
Name:
Alternaroside CFormula:
C42H77O9NSmiles:
CCCCCCCCCC=CCCC=CC(O)C(COC1OC(CO)C(O)C(O)C1O)N=C(O)C(O)C=CCCCCCCCCCCCCCCAglycone:
CCCCCCCCCC=CCCC=CC(O)C(CO)N=C(O)C(O)C=CCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.83 |
| AlogP: | 7.53 | Num_rotatable_bonds: | 33 |
| MolWt: | 740.08 | Num_heavy_atoms: | 52 |
| TPSA: | 172.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD49967
Formula: C36H67O4N
Smiles:
CCCCCCCCCC=CCCC=CC(O)C(CO)N=C(O)C(O)C=CCCCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 9.71 | Num_rotatable_bonds: | 30 |
| MolWt: | 577.94 | Num_heavy_atoms: | 41 |
| TPSA: | 93.28 | NumAromaticRings: | 0 |
