Glycoside
...
GD137627

Name:
Thermozeaxanthin-17

Formula:
C63H98O8

Smiles:
CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CC(OC2OC(COC(=O)CCCCCCCCCCCCCC(C)C)C(O)C(O)C2O)CC1(C)C

Aglycone:
CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C.COC(=O)CCCCCCCCCCCCCC(C)C

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 4 FractionCSP3: 0.63
AlogP: 14.65 Num_rotatable_bonds: 28
MolWt: 983.47 Num_heavy_atoms: 71
TPSA: 125.68 NumAromaticRings: 0

Unique Aglycone
AD46252
Formula: C40H56O2

Smiles:
CC(C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CC(O)CC1(C)C
HBA: 2 RingCount: 2
HBD: 2 FractionCSP3: 0.45
AlogP: 10.55 Num_rotatable_bonds: 10
MolWt: 568.89 Num_heavy_atoms: 42
TPSA: 40.46 NumAromaticRings: 0
AD55591
Formula: C18H36O2

Smiles:
COC(=O)CCCCCCCCCCCCCC(C)C
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.94
AlogP: 5.89 Num_rotatable_bonds: 14
MolWt: 284.48 Num_heavy_atoms: 20
TPSA: 26.3 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O