Glycoside
...
GD119769

Name:
2-{[2-({1-[5-(1,2-dihydroxypropan-2-yl)-2-methyloxolan-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl}oxy)-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol

Formula:
C48H82O17

Smiles:
CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CCC4C(C6(C)CCC(C(C)(O)CO)O6)CCC45C)C3(C)C)OC(CO)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O

Aglycone:
CC(O)(CO)C1CCC(C)(C2CCC3(C)C2CCC2C4(C)CCC(O)C(C)(C)C4CCC23C)O1

Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 8
HBD: 10 FractionCSP3: 1.0
AlogP: 1.24 Num_rotatable_bonds: 10
MolWt: 931.17 Num_heavy_atoms: 65
TPSA: 266.91 NumAromaticRings: 0

Unique Aglycone
AD48045
Formula: C30H52O4

Smiles:
CC(O)(CO)C1CCC(C)(C2CCC3(C)C2CCC2C4(C)CCC(O)C(C)(C)C4CCC23C)O1
HBA: 4 RingCount: 5
HBD: 3 FractionCSP3: 1.0
AlogP: 5.71 Num_rotatable_bonds: 3
MolWt: 476.74 Num_heavy_atoms: 34
TPSA: 69.92 NumAromaticRings: 0

Sugarmoiety
SD00732

CC1OC(OC2C(O)OC(CO)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O