Glycoside
...
GD148631

Name:
10-[(5-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-4,7-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

Formula:
C48H78O19

Smiles:
CC1OC(OC2C(OC3C(CO)OC(OC4CCC5(C)C(CC(O)C6(C)C5CC=C5C7CC(C)(C)CC(O)C7(C(=O)O)CCC56C)C4(C)C)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Aglycone:
CC1(C)CC(O)C2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CC(O)C43C)C2C1

Sugarmoiety:
CC1OC(OC2C(OC3C(CO)OC(O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 8
HBD: 12 FractionCSP3: 0.94
AlogP: -0.32 Num_rotatable_bonds: 9
MolWt: 959.13 Num_heavy_atoms: 67
TPSA: 315.21 NumAromaticRings: 0

Unique Aglycone
AD59463
Formula: C30H48O5

Smiles:
CC1(C)CC(O)C2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CC(O)C43C)C2C1
HBA: 5 RingCount: 5
HBD: 4 FractionCSP3: 0.9
AlogP: 5.18 Num_rotatable_bonds: 1
MolWt: 488.71 Num_heavy_atoms: 35
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD01439

CC1OC(OC2C(OC3C(CO)OC(O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O