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Compounds

COMPOUND NPA004244

STRUCTURE
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PROPERTIES
NPAID NPA004244
CLUSTER ID 36
NODE ID 35
NAME Actinotetraose J
FORMULA C55H80O27
MOLECULAR WEIGHT (Da) 1173.2180
ACCURATE MASS (Da) 1172.4887
ORIGIN ORGANISM TYPE Bacterium
ORIGIN GENUS Amycolatopsis
ORIGIN SPECIES sp. HCa1
InChIKey AMTFIMPMNYTAKH-FSHAHHAUSA-N
InChI InChI=1S/C55H80O27/c1-13-24(8)46(64)70-22-32-34(58)36(60)44(80-52-38(62)42(78-50(68)28(12)17-5)40(30(20-56)72-52)76-48(66)26(10)15-3)54(74-32)82-55-45(37(61)35(59)33(75-55)23-71-47(65)25(9)14-2)81-53-39(63)43(79-51(69)29(18-6)19-7)41(31(21-57)73-53)77-49(67)27(11)16-4/h13-18,30-45,52-63H,19-23H2,1-12H3/b24-13+,25-14+,26-15+,27-16+,28-17+,29-18+/t30-,31-,32-,33-,34-,35-,36+,37+,38-,39-,40-,41-,42-,43-,44-,45-,52+,53+,54-,55-/m1/s1
SMILES CC/C(=C\C)/C(=O)O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OC(=O)/C(=C/C)/C)CO)O[C@@H]2[C@H]([C@@H]([C@H](O[C@@H]2O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)/C(=C/C)/C)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)OC(=O)/C(=C/C)/C)OC(=O)/C(=C/C)/C)O)COC(=O)/C(=C/C)/C)O)O)O
ORIGINAL ISOLATION REFERENCE
CITATION Guo, Zhi-Kai; Jiao, Rui-Hua; Dai, Hao-Fu; Mei, Wen-Li; Tan, Ren-Xiang; Ge, Hui-Ming Actinotetraoses I-K: Tetrasaccharide metabolites produced by an insect-derived actinobacteria, Amycolatopsis sp. HCa1 Chemistry and Biodiversity 2013 10 (2) 296-302.
DOI 10.1002/cbdv.201200224 PMID 23418177
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Bacteria LPSN 2
Phylum Actinobacteria LPSN 201174
Class Actinobacteria LPSN -
Order Pseudonocardiales LPSN 85010
Family Pseudonocardiaceae LPSN 2070
Genus Amycolatopsis LPSN 1813
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