AB06515
20575-57-9 | Calycosin
Manufacturer: A2B Chem
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CatalogNumber
AB06515
ChemicalName
Calycosin
CasNumber
20575-57-9
MolecularFormula
C16H12O5
MolecularWeight
284.2635
MdlNumber
MFCD00210598
Smiles
COc1ccc(cc1O)c1coc2c(c1=O)ccc(c2)O
Complexity
432
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AB06515
ChemicalName: Calycosin
CasNumber: 20575-57-9
MolecularFormula: C16H12O5
MolecularWeight: 284.2635
MdlNumber: MFCD00210598
Smiles: COc1ccc(cc1O)c1coc2c(c1=O)ccc(c2)O
Complexity: 432
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AB06515
ChemicalName:
Calycosin
CasNumber:
20575-57-9
MolecularFormula:
C16H12O5
MolecularWeight:
284.2635
MdlNumber:
MFCD00210598
Smiles:
COc1ccc(cc1O)c1coc2c(c1=O)ccc(c2)O
Complexity:
432
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC(C([N+](=O)[O-])(C)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
CC(C([N+](=O)[O-])(C)C)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: Cc1c(C)cncc1C
Complexity: __
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Xlogp3: __
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MolecularFormula:
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Smiles:
Cc1c(C)cncc1C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: Nc1nc(Nc2ccc(c(c2)S(=O)(=O)[O-])C=Cc2ccc(cc2S(=O)(=O)[O-])Nc2nc(N)nc(n2)Nc2ccccc2)nc(n1)Nc1ccccc1.[Na+].[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nc(Nc2ccc(c(c2)S(=O)(=O)[O-])C=Cc2ccc(cc2S(=O)(=O)[O-])Nc2nc(N)nc(n2)Nc2ccccc2)nc(n1)Nc1ccccc1.[Na+].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__