Glycoside
...
GD005311

Name:
None

Formula:
C49H81O12N5

Smiles:
CC(=O)N[C@H]1[C@H](OC(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)N[C@H](C)C(=O)O[C@@H]2CC[C@]3(C)C(=CC[C@H]4[C@@H]5CC[C@@H]([C@H](C)CCCC(C)C)[C@]5(C)CC[C@H]43)C2)C(N)=O)[C@@H](O)[C@@H](CO)O[C@H]1O

Aglycone:
CC(C)CCCC(C)C1CCC2C3CC=C4CC(OC(=O)C(C)NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)CCC4(C)C3CCC12C

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 5
HBD: 9 FractionCSP3: 0.84
AlogP: 3.05 Num_rotatable_bonds: 20
MolWt: 932.21 Num_heavy_atoms: 66
TPSA: 264.94 NumAromaticRings: 0

Unique Aglycone
AD04534
Formula: C41H68O7N4

Smiles:
CC(C)CCCC(C)C1CCC2C3CC=C4CC(OC(=O)C(C)NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)CCC4(C)C3CCC12C
HBA: 11 RingCount: 4
HBD: 6 FractionCSP3: 0.83
AlogP: 5.08 Num_rotatable_bonds: 16
MolWt: 729.02 Num_heavy_atoms: 52
TPSA: 176.92 NumAromaticRings: 0

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O