Glycoside
...
GD014674

Name:
None

Formula:
C53H95O15N

Smiles:
CCCCCCCC(=O)O[C@@H]1[C@H](O[C@@H]2[C@H](C)[C@H](O[C@@H]3C[C@@](C)(OC)[C@H](O)[C@H](C)O3)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](OC(=O)CCCCCCC)[C@H](C)C(=O)[C@H](C)C[C@]2(C)O)O[C@H](C)C[C@H]1N(C)C

Aglycone:
CCCCCCCC(=O)OC1C(OC2C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(OC(=O)CCCCCCC)C(C)C(=O)C(C)CC2(C)O)OC(C)CC1N(C)C

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 3
HBD: 3 FractionCSP3: 0.92
AlogP: 7.61 Num_rotatable_bonds: 21
MolWt: 986.33 Num_heavy_atoms: 69
TPSA: 206.05 NumAromaticRings: 0

Unique Aglycone
AD10767
Formula: C45H81O12N

Smiles:
CCCCCCCC(=O)OC1C(OC2C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(OC(=O)CCCCCCC)C(C)C(=O)C(C)CC2(C)O)OC(C)CC1N(C)C
HBA: 13 RingCount: 2
HBD: 3 FractionCSP3: 0.91
AlogP: 6.68 Num_rotatable_bonds: 18
MolWt: 828.14 Num_heavy_atoms: 58
TPSA: 178.36 NumAromaticRings: 0

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O