Clerocidin structure

Clerocidin

Also Known As: Clerocidin|Antibiotic PR-1350|PR 1350|PR-1350|1-Naphthalenecarboxaldehyde, 5,5'-((tetrahydro-3'a,7'a-dihydroxydispiro(oxirane-2,3'(2'H)-difuro(2,3-b:2',3'-e)(1,4)dioxin-7'(6'H),2''-oxirane)-2',6'-diyl)bis(methylene))bis(3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-|1-Naphthalenecarboxaldehyde, 5,5'-((tetrahydro-3'a,7'a-dihydroxydispiro(oxirane-2,3'(2'H)-difuro(2,3-b:2',3'-e)(1,4)dioxin-7'(6'H),2''-oxirane)-2',6'-diyl)bis(methylene))bis(3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl)

CAS: 87501-14-2
Molecular Formula C40H56O10
Molecular Weight 696.3873 g/mol
LogP 5.134
Topological Polar Surface Area 136.58 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 6
Exact Mass 696.3873
Monoisotopic Mass 696.3873
Heavy Atoms 50
Complexity 1420.9438

Chemical Identifiers

CAS Number 87501-14-2
SMILES CC1CCC2(C(C1(C)CC3C4(CO4)C5(C(O3)OC6(C(O5)OC(C67CO7)CC8(C(CCC9(C8CCC=C9C=O)C)C)C)O)O)CCC=C2C=O)C

Product Overview

Clerocidin (CAS 87501-14-2), with molecular formula C40H56O10 and molecular weight 696.3873 g/mol.

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