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Compounds

COMPOUND NPA028330

STRUCTURE
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PROPERTIES
NPAID NPA028330
CLUSTER ID 736
NODE ID 642
NAME Cylindrocyclophane F
FORMULA C36H56O4
MOLECULAR WEIGHT (Da) 552.8400
ACCURATE MASS (Da) 552.4179
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Cylindrospermum
ORIGIN SPECIES licheniforme
InChIKey AAGAYZNADYXWIQ-ATACATFBSA-N
InChI InChI=1S/C36H56O4/c1-5-7-15-29-17-11-9-13-25(3)20-28-23-33(39)36(34(40)24-28)30(16-8-6-2)18-12-10-14-26(4)19-27-21-31(37)35(29)32(38)22-27/h21-26,29-30,37-40H,5-20H2,1-4H3/t25-,26-,29-,30-/m0/s1
SMILES CCCC[C@H]1CCCC[C@H](C)CC2=CC(O)=C(C(O)=C2)[C@@H](CCCC)CCCC[C@H](C)CC2=CC(O)=C1C(O)=C2
ORIGINAL ISOLATION REFERENCE
CITATION Moore B;Chen J;Patterson G;Moore R Structures of cylindrocyphanes A-F Tetrahedron 1992 48 (15) 3001-3006.
DOI 10.1016/s0040-4020(01)92244-6 PMID -
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Bacteria LPSN 2
Phylum Cyanobacteria LPSN 1117
Class Cyanophyceae LPSN -
Order Nostocales LPSN 1161
Family Nostocaceae LPSN 1162
Genus Cylindrospermum LPSN 56106
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