Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033505
PROPERTIES
| NPAID | NPA033505 |
|---|---|
| CLUSTER ID | 7772 |
| NODE ID | 5298 |
| NAME | Chitinimide B |
| FORMULA | C48H71N13O14S2 |
| MOLECULAR WEIGHT (Da) | 1118.3070 |
| ACCURATE MASS (Da) | 1117.4685 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Chitinimonas |
| ORIGIN SPECIES | koreensis DSM 17726 |
| InChIKey | VJVSLBMNZWUBIP-UHHYSGKUSA-N |
| InChI | InChI=1S/C48H71N13O14S2/c1-6-27(37(64)54-30(16-12-19-51-47(49)50)44(70)61-20-13-17-36(61)43-58-35(25-77-43)42(69)55-31(18-21-76-5)46(73)75-4)52-40(67)33(23-62)56-38(65)28(7-2)53-41(68)34(24-63)57-39(66)29(8-3)59-48(74)60-32(45(71)72)22-26-14-10-9-11-15-26/h6-11,14-15,30-36,43,58,62-63H,12-13,16-25H2,1-5H3,(H,52,67)(H,53,68)(H,54,64)(H,55,69)(H,56,65)(H,57,66)(H,71,72)(H4,49,50,51)(H2,59,60,74)/b27-6-,28-7-,29-8-/t30-,31-,32-,33-,34-,35?,36-,43-/m0/s1 |
| SMILES | C/C=C(\NC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N/C(=C\C)C(=O)N[C@@H](CO)C(=O)N/C(=C\C)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)OC)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. | ||
|---|---|---|---|
| DOI | 10.1038/s41467-021-24645-0 | PMID | 34301933 |
