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91700-91-3,MFCD09752707
Catalog No.:AA01EPRL

91700-91-3 | 18,21-didehydro-17-demethoxy-18,21-dideoxo-18,21-dihydroxy-15R-methoxy-geldanamycin

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2.5mg
>95.00%
3 weeks  
$3,275.00   $2,293.00
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Technical Information
Catalog Number:
AA01EPRL
Chemical Name:
18,21-didehydro-17-demethoxy-18,21-dideoxo-18,21-dihydroxy-15R-methoxy-geldanamycin
CAS Number:
91700-91-3
Molecular Formula:
C29H42N2O9
Molecular Weight:
562.6518
MDL Number:
MFCD09752707
SMILES:
CO[C@H]1C[C@H](C)[C@@H](OC)c2cc(O)cc(c2O)NC(=O)/C(=C/C=C/[C@@H]([C@H](/C(=C/[C@@H]([C@H]1O)C)/C)OC(=O)N)OC)/C
Properties
Computed Properties
 
Complexity:
937  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
7  
Defined Bond Stereocenter Count:
3  
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
5  
XLogP3:
2.2  

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SDS
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Tags:91700-91-3 Molecular Formula|91700-91-3 MDL|91700-91-3 SMILES|91700-91-3 18,21-didehydro-17-demethoxy-18,21-dideoxo-18,21-dihydroxy-15R-methoxy-geldanamycin