Glycoside
...
GD145485

Name:
4,8a-dimethyl 2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4,8a-dicarboxylate

Formula:
C38H60O11

Smiles:
COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CC(O)C(OC5OC(CO)C(O)C(O)C5O)C(C)(C(=O)OC)C4CCC3(C)C1(C)CC2

Aglycone:
COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(C(=O)OC)C4CCC3(C)C1(C)CC2

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

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 5 FractionCSP3: 0.89
AlogP: 3.27 Num_rotatable_bonds: 5
MolWt: 692.89 Num_heavy_atoms: 49
TPSA: 172.21 NumAromaticRings: 0

Unique Aglycone
AD58396
Formula: C32H50O6

Smiles:
COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(C(=O)OC)C4CCC3(C)C1(C)CC2
HBA: 6 RingCount: 5
HBD: 2 FractionCSP3: 0.88
AlogP: 5.45 Num_rotatable_bonds: 2
MolWt: 530.75 Num_heavy_atoms: 38
TPSA: 93.06 NumAromaticRings: 0

Sugarmoiety
SD00003

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