AB49957
13574-13-5 | Boc-Glu(OBzl)-OH
Manufacturer: A2B Chem
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CatalogNumber
AB49957
ChemicalName
Boc-Glu(OBzl)-OH
CasNumber
13574-13-5
MolecularFormula
C17H23NO6
MolecularWeight
337.3676
MdlNumber
MFCD00065569
Smiles
O=C(OCc1ccccc1)CC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity
437
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
10
Xlogp3
2.2
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CatalogNumber: AB49957
ChemicalName: Boc-Glu(OBzl)-OH
CasNumber: 13574-13-5
MolecularFormula: C17H23NO6
MolecularWeight: 337.3676
MdlNumber: MFCD00065569
Smiles: O=C(OCc1ccccc1)CC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 437
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: 2.2
CatalogNumber:
AB49957
ChemicalName:
Boc-Glu(OBzl)-OH
CasNumber:
13574-13-5
MolecularFormula:
C17H23NO6
MolecularWeight:
337.3676
MdlNumber:
MFCD00065569
Smiles:
O=C(OCc1ccccc1)CC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
437
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(CN1CCNCC1)(F)F.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(CN1CCNCC1)(F)F.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CO[C@@H]1[C@H](O)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)CO
Complexity: 385
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -1.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CO[C@@H]1[C@H](O)[C@H](O[C@H]1n1ccc(=O)[nH]c1=O)CO
Complexity:
385
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-1.4
CatalogNumber: AB49960
ChemicalName: (8S,9S,10R,13R,14S,17R)-17-((R)-6-Hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
CasNumber: 2140-46-7
MolecularFormula: C27H46O2
MolecularWeight: 402.6529
MdlNumber: MFCD00057815
Smiles: O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(O)(C)C)C)C)C1)C
Complexity: 636
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 8
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 6.8
CatalogNumber:
AB49960
ChemicalName:
(8S,9S,10R,13R,14S,17R)-17-((R)-6-Hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
CasNumber:
2140-46-7
MolecularFormula:
C27H46O2
MolecularWeight:
402.6529
MdlNumber:
MFCD00057815
Smiles:
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(O)(C)C)C)C)C1)C
Complexity:
636
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
8
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
6.8