Glycoside
...
GD131376

Name:
3-(5-{[4-(1,2-dihydroxyethyl)-3-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-2-(2-{[5-formyl-4-methyl-3-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-1H-pyrrol-2-yl]methyl}-5-(methoxycarbonyl)-3-methyl-4-oxo-1H,4H,5H,6H-cyclopenta[b]pyrrol-6-yl)-4-methyl-1H-pyrrol-3-yl)propanoic acid

Formula:
C41H50O15N4

Smiles:
COC(=O)C1C(=O)c2c([nH]c(Cc3[nH]c(C=O)c(C)c3CCOC3OC(CO)C(O)C(O)C3O)c2C)C1c1[nH]c(C=C2NC(=O)C(C(O)CO)=C2C)c(C)c1CCC(=O)O

Aglycone:
COC(=O)C1C(=O)c2c([nH]c(Cc3[nH]c(C=O)c(C)c3CCO)c2C)C1c1[nH]c(C=C2NC(=O)C(C(O)CO)=C2C)c(C)c1CCC(=O)O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 6
HBD: 11 FractionCSP3: 0.49
AlogP: -0.37 Num_rotatable_bonds: 16
MolWt: 838.86 Num_heavy_atoms: 60
TPSA: 314.05 NumAromaticRings: 3

Unique Aglycone
AD53230
Formula: C35H40O10N4

Smiles:
COC(=O)C1C(=O)c2c([nH]c(Cc3[nH]c(C=O)c(C)c3CCO)c2C)C1c1[nH]c(C=C2NC(=O)C(C(O)CO)=C2C)c(C)c1CCC(=O)O
HBA: 14 RingCount: 5
HBD: 8 FractionCSP3: 0.4
AlogP: 1.81 Num_rotatable_bonds: 13
MolWt: 676.72 Num_heavy_atoms: 49
TPSA: 234.9 NumAromaticRings: 3

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O