AG66455
64820-99-1 | Vitexin-2″-O-Rhamnoside
Manufacturer: A2B Chem
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CatalogNumber
AG66455
ChemicalName
Vitexin-2″-O-Rhamnoside
CasNumber
64820-99-1
MolecularFormula
C27H30O14
MolecularWeight
578.5187
MdlNumber
MFCD29913069
Smiles
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O
Complexity
954
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
10
HeavyAtomCount
41
HydrogenBondAcceptorCount
14
HydrogenBondDonorCount
9
RotatableBondCount
5
Xlogp3
-0.9
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CatalogNumber: AG66455
ChemicalName: Vitexin-2″-O-Rhamnoside
CasNumber: 64820-99-1
MolecularFormula: C27H30O14
MolecularWeight: 578.5187
MdlNumber: MFCD29913069
Smiles: OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O
Complexity: 954
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 10
HeavyAtomCount: 41
HydrogenBondAcceptorCount: 14
HydrogenBondDonorCount: 9
RotatableBondCount: 5
Xlogp3: -0.9
CatalogNumber:
AG66455
ChemicalName:
Vitexin-2″-O-Rhamnoside
CasNumber:
64820-99-1
MolecularFormula:
C27H30O14
MolecularWeight:
578.5187
MdlNumber:
MFCD29913069
Smiles:
OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O
Complexity:
954
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
10
HeavyAtomCount:
41
HydrogenBondAcceptorCount:
14
HydrogenBondDonorCount:
9
RotatableBondCount:
5
Xlogp3:
-0.9
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Smiles: N1CCN(CC1)c1ccc2c(c1)cccc2
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Smiles:
N1CCN(CC1)c1ccc2c(c1)cccc2
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Smiles: CC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=C(C=C3)OC
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=C(C=C3)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__