Glycoside
...
GD126463

Name:
1-[1,3a,3b,5a-tetrahydroxy-7-({5-[(5-{[5-({4-hydroxy-5-[(3-hydroxy-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-9a,11a-dimethyl-11-[(3-phenylprop-2-enoyl)oxy]-1H,2H,3H,3aH,3bH,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethyl 2-methylbut-2-enoate

Formula:
C75H114O30

Smiles:
CC=C(C)C(=O)OC(C)C1(O)CCC2(O)C3(O)C=CC4(O)CC(OC5CC(OC)C(OC6CC(OC)C(OC7CC(OC)C(OC8CC(O)C(OC9OC(C)C(OC%10OC(CO)C(O)C(O)C%10O)C(OC)C9O)C(C)O8)C(C)O7)C(C)O6)C(C)O5)CCC4(C)C3CC(OC(=O)C=Cc3ccccc3)C12C

Aglycone:
CC=C(C)C(=O)OC(C)C1(O)CCC2(O)C3(O)C=CC4(O)CC(O)CCC4(C)C3CC(OC(=O)C=Cc3ccccc3)C12C

Sugarmoiety:
COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(O)C(OC4OC(C)C(OC5OC(CO)C(O)C(O)C5O)C(OC)C4O)C(C)O3)C(C)O2)C(C)O1

Other Identifiers

Properties
HBA: 30 RingCount: 11
HBD: 10 FractionCSP3: 0.81
AlogP: 2.19 Num_rotatable_bonds: 23
MolWt: 1495.71 Num_heavy_atoms: 105
TPSA: 402.58 NumAromaticRings: 1

Unique Aglycone
AD47972
Formula: C35H46O9

Smiles:
CC=C(C)C(=O)OC(C)C1(O)CCC2(O)C3(O)C=CC4(O)CC(O)CCC4(C)C3CC(OC(=O)C=Cc3ccccc3)C12C
HBA: 9 RingCount: 5
HBD: 5 FractionCSP3: 0.6
AlogP: 3.37 Num_rotatable_bonds: 6
MolWt: 610.74 Num_heavy_atoms: 44
TPSA: 153.75 NumAromaticRings: 1

Sugarmoiety
SD06632

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(O)C(OC4OC(C)C(OC5OC(CO)C(O)C(O)C5O)C(OC)C4O)C(C)O3)C(C)O2)C(C)O1