252869-81-1,MFCD31544498
Catalog No.:AA01ENG7

252869-81-1 | st-Ht31 P

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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA01ENG7
Chemical Name:
st-Ht31 P
CAS Number:
252869-81-1
Molecular Formula:
C127H209N29O39
Molecular Weight:
2766.1893
MDL Number:
MFCD31544498
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)C)C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O)CC(C)C)CCC(=O)O)CCC(=O)O)C)C)CO)CCCNC(=N)N)CC(=O)O)C)CCC(=O)O)CCC(=O)N
Properties
Computed Properties
 
Complexity:
6200  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
24  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
195  
Hydrogen Bond Acceptor Count:
41  
Hydrogen Bond Donor Count:
35  
Isotope Atom Count:
0  
Rotatable Bond Count:
97  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.3  

Literature
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SDS
Tags:252869-81-1 Molecular Formula|252869-81-1 MDL|252869-81-1 SMILES|252869-81-1 st-Ht31 P
Catalog No.: AA01ENG7
252869-81-1,MFCD31544498
252869-81-1 | st-Ht31 P
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA01ENG7
Chemical Name: st-Ht31 P
CAS Number: 252869-81-1
Molecular Formula: C127H209N29O39
Molecular Weight: 2766.1893
MDL Number: MFCD31544498
SMILES: NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)C)C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O)CC(C)C)CCC(=O)O)CCC(=O)O)C)C)CO)CCCNC(=N)N)CC(=O)O)C)CCC(=O)O)CCC(=O)N
Properties
Complexity: 6200  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 24  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 195  
Hydrogen Bond Acceptor Count: 41  
Hydrogen Bond Donor Count: 35  
Isotope Atom Count: 0  
Rotatable Bond Count: 97  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.3  
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