Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA033509
PROPERTIES
NPAID | NPA033509 |
---|---|
CLUSTER ID | 7772 |
NODE ID | 5298 |
NAME | Chitinimide E |
FORMULA | C40H59N11O11S2 |
MOLECULAR WEIGHT (Da) | 934.1120 |
ACCURATE MASS (Da) | 933.3837 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Chitinimonas |
ORIGIN SPECIES | koreensis DSM 17726 |
InChIKey | GWUHJAFRKSUHOU-CUIYLFHFSA-N |
InChI | InChI=1S/C40H59N11O11S2/c1-4-23(44-33(55)28(20-52)47-32(54)24(5-2)49-40(62)50-27(38(60)61)19-22-11-7-6-8-12-22)31(53)45-25(13-9-16-43-39(41)42)36(57)51-17-10-14-30(51)35-48-29(21-64-35)34(56)46-26(37(58)59)15-18-63-3/h4-8,11-12,25-30,35,48,52H,9-10,13-21H2,1-3H3,(H,44,55)(H,45,53)(H,46,56)(H,47,54)(H,58,59)(H,60,61)(H4,41,42,43)(H2,49,50,62)/t25-,26-,27-,28-,29?,30-,35-/m0/s1 |
SMILES | CC=C(NC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)N[C@@H](CO)C(=O)NC(=CC)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1[C@H]1NC(C(=O)N[C@@H](CCSC)C(=O)O)CS1 |
ORIGINAL ISOLATION REFERENCE
CITATION | Liu, Jiaqi; Zhou, Haibo; Yang, Zhiyu; Wang, Xue; Chen, Hanna; Zhong, Lin; Zheng, Wentao; Niu, Weijing; Wang, Sen; Ren, Xiangmei; Zhong, Guannan; Wang, Yan; Ding, Xiaoming; Müller, Rolf; Zhang, Youming; Bian, Xiaoying Rational construction of genome-reduced Burkholderiales chassis facilitates efficient heterologous production of natural products from proteobacteria Nature Communications 2021 12 (1) 4347. | ||
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DOI | 10.1038/s41467-021-24645-0 | PMID | 34301933 |