AB04666
20347-71-1 | Procyanidin
Manufacturer: A2B Chem
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CatalogNumber
AB04666
ChemicalName
Procyanidin
CasNumber
20347-71-1
MolecularFormula
C30H26O13
MolecularWeight
594.5196399999999
MdlNumber
MFCD01662851
Smiles
Oc1cc(O)c2c(c1)OC(C(C2)OC1(Oc2cc(O)cc(c2C(C1O)O)O)c1ccc(c(c1)O)O)c1ccc(c(c1)O)O
Complexity
957
Covalently-bondedUnitCount
1
HeavyAtomCount
43
HydrogenBondAcceptorCount
13
HydrogenBondDonorCount
10
RotatableBondCount
4
UndefinedAtomStereocenterCount
5
Xlogp3
2
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CatalogNumber: AB04666
ChemicalName: Procyanidin
CasNumber: 20347-71-1
MolecularFormula: C30H26O13
MolecularWeight: 594.5196399999999
MdlNumber: MFCD01662851
Smiles: Oc1cc(O)c2c(c1)OC(C(C2)OC1(Oc2cc(O)cc(c2C(C1O)O)O)c1ccc(c(c1)O)O)c1ccc(c(c1)O)O
Complexity: 957
Covalently-bondedUnitCount: 1
HeavyAtomCount: 43
HydrogenBondAcceptorCount: 13
HydrogenBondDonorCount: 10
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 5
Xlogp3: 2
CatalogNumber:
AB04666
ChemicalName:
Procyanidin
CasNumber:
20347-71-1
MolecularFormula:
C30H26O13
MolecularWeight:
594.5196399999999
MdlNumber:
MFCD01662851
Smiles:
Oc1cc(O)c2c(c1)OC(C(C2)OC1(Oc2cc(O)cc(c2C(C1O)O)O)c1ccc(c(c1)O)O)c1ccc(c(c1)O)O
Complexity:
957
Covalently-bondedUnitCount:
1
HeavyAtomCount:
43
HydrogenBondAcceptorCount:
13
HydrogenBondDonorCount:
10
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
5
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)O[C@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)O[C@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: [Rb+].[BH4-]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[Rb+].[BH4-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)cc(c(n2)N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)cc(c(n2)N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__