AA74257
1492-18-8 | 5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt hydrate
Manufacturer: A2B Chem
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CatalogNumber
AA74257
ChemicalName
5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt hydrate
CasNumber
1492-18-8
MolecularFormula
C20H21CaN7O7
MolecularWeight
511.5014399999998
MdlNumber
MFCD00149463
Smiles
O=CN1C(CNc2ccc(cc2)C(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])CNc2c1c(=O)nc([nH]2)N.[Ca+2]
Complexity
900
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
35
HydrogenBondAcceptorCount
10
HydrogenBondDonorCount
5
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA74257
ChemicalName: 5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt hydrate
CasNumber: 1492-18-8
MolecularFormula: C20H21CaN7O7
MolecularWeight: 511.5014399999998
MdlNumber: MFCD00149463
Smiles: O=CN1C(CNc2ccc(cc2)C(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])CNc2c1c(=O)nc([nH]2)N.[Ca+2]
Complexity: 900
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 35
HydrogenBondAcceptorCount: 10
HydrogenBondDonorCount: 5
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA74257
ChemicalName:
5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt hydrate
CasNumber:
1492-18-8
MolecularFormula:
C20H21CaN7O7
MolecularWeight:
511.5014399999998
MdlNumber:
MFCD00149463
Smiles:
O=CN1C(CNc2ccc(cc2)C(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])CNc2c1c(=O)nc([nH]2)N.[Ca+2]
Complexity:
900
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
35
HydrogenBondAcceptorCount:
10
HydrogenBondDonorCount:
5
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
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Smiles: COC(=O)[C@H](C(C)C)NC(=O)C
Complexity: __
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Smiles:
COC(=O)[C@H](C(C)C)NC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
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MolecularFormula: __
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Smiles: COC(=O)[C@@H](NC(=O)C)CC(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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__
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H](NC(=O)C)CC(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
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ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: ONc1cccc2c1ccnc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ONc1cccc2c1ccnc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__