Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA011650
PROPERTIES
NPAID | NPA011650 |
---|---|
CLUSTER ID | 2283 |
NODE ID | 1808 |
NAME | Lobophorin B |
FORMULA | C61H90N2O21 |
MOLECULAR WEIGHT (Da) | 1187.3840 |
ACCURATE MASS (Da) | 1186.6036 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | OQCJHHCTOPGJEH-OZRRPFOLSA-N |
InChI | InChI=1S/C61H90N2O21/c1-27-14-17-42(80-47-25-59(10,63(72)73)54(35(9)79-47)62-58(71)75-13)28(2)19-37-20-36(26-64)31(5)24-61(37)56(69)48(57(70)84-61)55(68)60(11)39(27)16-15-38-49(60)29(3)18-30(4)51(38)82-46-23-43(50(67)32(6)76-46)81-44-22-41(66)53(34(8)78-44)83-45-21-40(65)52(74-12)33(7)77-45/h14-16,19-20,29-35,37-47,49-54,64-68H,17-18,21-26H2,1-13H3,(H,62,71)/t29-,30-,31+,32+,33+,34+,35+,37-,38-,39-,40-,41-,42?,43-,44-,45-,46-,47+,49+,50+,51-,52+,53+,54-,59-,60+,61?/m1/s1 |
SMILES | C[C@@H]1C[C@H]([C@H]([C@H]2[C@H]1[C@@]3([C@H](C=C2)C(=CCC(C(=C[C@@H]4C=C([C@H](CC45C(=O)C(=C3O)C(=O)O5)C)CO)C)O[C@H]6C[C@@]([C@@H]([C@@H](O6)C)NC(=O)OC)(C)[N+](=O)[O-])C)C)O[C@@H]7C[C@H]([C@H]([C@@H](O7)C)O)O[C@@H]8C[C@H]([C@H]([C@@H](O8)C)O[C@@H]9C[C@H]([C@H]([C@@H](O9)C)OC)O)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Wei, Rong-Bian; Xi, Tao; Li, Jing; Wang, Ping; Li, Fu-Chao; Lin, Yong-Cheng; Qin, Song Lobophorin C and D, New Kijanimicin Derivatives from a Marine Sponge-Associated Actinomycetal Strain AZS17 Marine Drugs 2011 9 (3) 359-368. | ||
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DOI | 10.3390/md9030359 | PMID | 21556165 |