Glycoside
GD149328
Name:
N-(1-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxydocos-9-en-2-yl)-2-hydroxyhexadecanamideFormula:
C50H95O15NSmiles:
CCCCCCCCCCCCC=CCCCCC(O)C(O)C(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)N=C(O)C(O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCC=CCCCCC(O)C(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 2 |
| HBD: | 11 | FractionCSP3: | 0.94 |
| AlogP: | 5.55 | Num_rotatable_bonds: | 40 |
| MolWt: | 950.3 | Num_heavy_atoms: | 66 |
| TPSA: | 271.81 | NumAromaticRings: | 0 |
Unique Aglycone
AD53195
Formula: C38H75O5N
Smiles:
CCCCCCCCCCCCC=CCCCCC(O)C(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 9.91 | Num_rotatable_bonds: | 34 |
| MolWt: | 626.02 | Num_heavy_atoms: | 44 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
