Glycoside
...
GD151996

Name:
2-{[5-(4-bromobuta-1,3-dien-1-yl)-1-hydroxy-2,7,10,10-tetramethyl-3,9-dioxo-4,15-dioxabicyclo[9.3.1]pentadec-7-en-13-yl]oxy}-3,5-dimethoxy-6-methyloxan-4-yl carbamate

Formula:
C30H44O11NBr

Smiles:
COC1C(C)OC(OC2CC3OC(O)(C2)C(C)C(=O)OC(C=CC=CBr)CC(C)=CC(=O)C3(C)C)C(OC)C1OC(=N)O

Aglycone:
CC1=CC(=O)C(C)(C)C2CC(O)CC(O)(O2)C(C)C(=O)OC(C=CC=CBr)C1

Sugarmoiety:
COC1C(C)OC(O)C(OC)C1OC(=N)O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 3 FractionCSP3: 0.7
AlogP: 3.85 Num_rotatable_bonds: 7
MolWt: 674.58 Num_heavy_atoms: 43
TPSA: 163.06 NumAromaticRings: 0

Unique Aglycone
AD46220
Formula: C21H29O6Br

Smiles:
CC1=CC(=O)C(C)(C)C2CC(O)CC(O)(O2)C(C)C(=O)OC(C=CC=CBr)C1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.62
AlogP: 3.17 Num_rotatable_bonds: 2
MolWt: 457.36 Num_heavy_atoms: 28
TPSA: 93.06 NumAromaticRings: 0

Sugarmoiety
SD09969

COC1C(C)OC(O)C(OC)C1OC(=N)O