BIAdb Myrocodin 2730
From DrugPedia: A Wikipedia for Drug discovery
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Revision as of 11:21, 20 November 2009
BIAdb Myrocodin 2730
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Systematic (IUPAC) name | |
N/A | |
Identifiers | |
CAS number | ? |
ATC code | ? |
PubChem | |
Chemical data | |
Formula | C38H51NO4 |
Mol. mass | 585.81584 |
SMILES | & |
Pharmacokinetic data | |
Bioavailability | ? |
Metabolism | ? |
Half life | ? |
Excretion | ? |
Therapeutic considerations | |
Pregnancy cat. |
? |
Legal status | |
Routes | ? |
Contents |
Description
Source
N/A
Function
Unknown
General Properties
*Molecular Weight
585.81584
*Exact Mass
585.381809
*Molecular Formula
C38H51NO4
*IUPAC NAME
N/A
*Canonical Smiles
CCCCCCCCCCCCCC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)OCC6=CC=CC=C6)CCN3C
*Isomeric Smiles
CCCCCCCCCCCCCC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OCC6=CC=CC=C6)CCN3C
*XLogP
9.5
*Hydrogen bond donor
0
*Hydrogen bond acceptor
5
*Rotational Bond Count
17
*Topological Polar Surface Area
48