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Compounds

COMPOUND NPA017132

STRUCTURE
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PROPERTIES
NPAID NPA017132
CLUSTER ID 736
NODE ID 642
NAME Carbamidocyclophane D
FORMULA C38H57ClN2O8
MOLECULAR WEIGHT (Da) 705.3330
ACCURATE MASS (Da) 704.3803
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Nostoc
ORIGIN SPECIES sp. CAVN 10
InChIKey YSZWKXRRCFZDNI-MJVHAFATSA-N
InChI InChI=1S/C38H57ClN2O8/c1-4-5-14-25-15-8-6-12-23(2)36(49-38(41)47)28-21-31(44)34(32(45)22-28)26(17-10-11-18-39)16-9-7-13-24(3)35(48-37(40)46)27-19-29(42)33(25)30(43)20-27/h19-26,35-36,42-45H,4-18H2,1-3H3,(H2,40,46)(H2,41,47)/t23-,24-,25?,26?,35+,36+/m0/s1
SMILES CCCCC1CCCC[C@@H]([C@H](C2=CC(=C(C(CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCCCl)C(=C2)O)O)OC(=O)N)C
ORIGINAL ISOLATION REFERENCE
CITATION Bui, Ha T. N.; Jansen, Rolf; Pham, Hang T. L.; Mundt, Sabine Carbamidocyclophanes A-E, chlorinated paracyclophanes with cytotoxic and antibiotic activity from the Vietnamese cyanobacterium Nostoc sp Journal of Natural Products 2007 70 (4) 499-503.
DOI 10.1021/np060324m PMID 17311455
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 Nostoc LPSN 1177
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