Glycoside
...
GD123934

Name:
2,3,4-trihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentyl 10-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-5-hydroxy-4a,9-bis(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b-octadecahydropicene-2-carboxylate

Formula:
C53H86O24

Smiles:
CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC3=C5CC(C)(C(=O)OCC(O)C(O)C(O)COC6OC(CO)C(O)C(O)C6O)CCC5(CO)C(O)CC34C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O

Aglycone:
CC1(C=O)CCC2(CO)C(=C3C=CC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC2O)C1

Sugarmoiety:
CC1OC(O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O.OCC1OC(OCC(O)C(O)C(O)COO)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 8
HBD: 16 FractionCSP3: 0.91
AlogP: -3.9 Num_rotatable_bonds: 16
MolWt: 1107.25 Num_heavy_atoms: 77
TPSA: 405.36 NumAromaticRings: 0

Unique Aglycone
AD45940
Formula: C30H46O5

Smiles:
CC1(C=O)CCC2(CO)C(=C3C=CC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CC2O)C1
HBA: 5 RingCount: 5
HBD: 4 FractionCSP3: 0.83
AlogP: 4.18 Num_rotatable_bonds: 3
MolWt: 486.69 Num_heavy_atoms: 35
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD06233

CC1OC(O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O.OCC1OC(OCC(O)C(O)C(O)COO)C(O)C(O)C1O