Glycoside
...
GD118493

Name:
20-amino-14-{[2-formyl-3-(1-hydroxycyclohexyl)phenyl]methyl}-13,23-dihydroxy-7-(hydroxymethyl)-10,30-dioxo-15-[(3,4,4,5-tetrahydroxy-6-methyloxan-2-yl)oxy]pentacyclo[23.3.1.1⁸,¹².0⁴,⁹.0¹¹,¹⁶]triaconta-1(28),2,4(9),5,7,11(16),12,14,25(29),26-decaen-18-yn-5-yl acetate

Formula:
C53H55O15N

Smiles:
CC(=O)Oc1cc(CO)c2c3c1C=Cc1cccc(c1)CC(O)CCC(N)C#CCc1c(OC4OC(C)C(O)C(O)(O)C4O)c(Cc4cccc(C5(O)CCCCC5)c4C=O)c(O)c(c1C3=O)C2=O

Aglycone:
CC(=O)Oc1cc(CO)c2c3c1C=Cc1cccc(c1)CC(O)CCC(N)C#CCc1c(O)c(Cc4cccc(C5(O)CCCCC5)c4C=O)c(O)c(c1C3=O)C2=O

Sugarmoiety:
CC1OC(O)C(O)C(O)(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 8
HBD: 10 FractionCSP3: 0.4
AlogP: 3.41 Num_rotatable_bonds: 8
MolWt: 946.02 Num_heavy_atoms: 69
TPSA: 283.83 NumAromaticRings: 4

Unique Aglycone
AD47387
Formula: C47H45O10N

Smiles:
CC(=O)Oc1cc(CO)c2c3c1C=Cc1cccc(c1)CC(O)CCC(N)C#CCc1c(O)c(Cc4cccc(C5(O)CCCCC5)c4C=O)c(O)c(c1C3=O)C2=O
HBA: 11 RingCount: 7
HBD: 7 FractionCSP3: 0.32
AlogP: 5.59 Num_rotatable_bonds: 6
MolWt: 783.87 Num_heavy_atoms: 58
TPSA: 204.68 NumAromaticRings: 4

Sugarmoiety
SD04321

CC1OC(O)C(O)C(O)(O)C1O