AG21319
482-38-2 | Kaempferitrin
Manufacturer: A2B Chem
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CatalogNumber
AG21319
ChemicalName
Kaempferitrin
CasNumber
482-38-2
MolecularFormula
C27H30O14
MolecularWeight
578.5187
MdlNumber
MFCD21333499
Smiles
Oc1ccc(cc1)c1oc2cc(O[C@@H]3O[C@@H](C)[C@@H]([C@H]([C@H]3O)O)O)cc(c2c(=O)c1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O
Complexity
968
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
10
HeavyAtomCount
41
HydrogenBondAcceptorCount
14
HydrogenBondDonorCount
8
RotatableBondCount
5
Xlogp3
-0.1
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CatalogNumber: AG21319
ChemicalName: Kaempferitrin
CasNumber: 482-38-2
MolecularFormula: C27H30O14
MolecularWeight: 578.5187
MdlNumber: MFCD21333499
Smiles: Oc1ccc(cc1)c1oc2cc(O[C@@H]3O[C@@H](C)[C@@H]([C@H]([C@H]3O)O)O)cc(c2c(=O)c1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O
Complexity: 968
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 10
HeavyAtomCount: 41
HydrogenBondAcceptorCount: 14
HydrogenBondDonorCount: 8
RotatableBondCount: 5
Xlogp3: -0.1
CatalogNumber:
AG21319
ChemicalName:
Kaempferitrin
CasNumber:
482-38-2
MolecularFormula:
C27H30O14
MolecularWeight:
578.5187
MdlNumber:
MFCD21333499
Smiles:
Oc1ccc(cc1)c1oc2cc(O[C@@H]3O[C@@H](C)[C@@H]([C@H]([C@H]3O)O)O)cc(c2c(=O)c1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O
Complexity:
968
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
10
HeavyAtomCount:
41
HydrogenBondAcceptorCount:
14
HydrogenBondDonorCount:
8
RotatableBondCount:
5
Xlogp3:
-0.1
CatalogNumber: __
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MolecularFormula: __
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Smiles: O=C1NCCNC1c1ccccc1
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Smiles:
O=C1NCCNC1c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
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Smiles: CC1(CCCC1)C(=O)O
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Smiles:
CC1(CCCC1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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Smiles: Clc1ccc2c(c1)[nH]c(n2)C(C)C
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc2c(c1)[nH]c(n2)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__