Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002824
PROPERTIES
| NPAID | NPA002824 |
|---|---|
| CLUSTER ID | 34 |
| NODE ID | 33 |
| NAME | Madurastatin A1 |
| FORMULA | C27H39N7O9 |
| MOLECULAR WEIGHT (Da) | 605.6490 |
| ACCURATE MASS (Da) | 605.2809 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Actinomadura |
| ORIGIN SPECIES | madurae |
| InChIKey | ZBCKLQPMOIHDEZ-VHBXLISGSA-N |
| InChI | InChI=1S/C27H39N7O9/c1-16(30-25(39)20-15-43-26(32-20)17-7-3-4-10-21(17)35)23(37)29-12-11-22(36)33(41)13-5-8-18(28-2)24(38)31-19-9-6-14-34(42)27(19)40/h3-4,7,10,16,18-20,28,35,41-42H,5-6,8-9,11-15H2,1-2H3,(H,29,37)(H,30,39)(H,31,38)/t16-,18?,19-,20?/m0/s1 |
| SMILES | CNC(CCCN(O)C(=O)CCNC(=O)[C@H](C)NC(=O)C1COC(C2=CC=CC=C2O)=N1)C(=O)N[C@H]1CCCN(O)C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | HARADA, KEN-ICHI; TOMITA, KOJI; FUJII, KIYONAGA; MASUDA, KATSUYOSHI; MIKAMI, YUZURU; YAZAWA, KATSUKIYO; KOMAKI, HISAYUKI Isolation and Structural Characterization of Siderophores, Madurastatins, Produced by a Pathogenic Actinomadura madurae Journal of Antibiotics 2004 57 (2) 125-135. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.57.125 | PMID | 15112961 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | C[C@@H](C(=O)NCCC(=O)N(CCCC(C(=O)N[C@H]1CCCN(C1=O)O)NC)O)NC(=O)[C@H]2CN2C(=O)C3=CC=CC=C3O | HARADA, KEN-ICHI; TOMITA, KOJI; FUJII, KIYONAGA; MASUDA, KATSUYOSHI; MIKAMI, YUZURU; YAZAWA, KATSUKIYO; KOMAKI, HISAYUKI Isolation and Structural Characterization of Siderophores, Madurastatins, Produced by a Pathogenic Actinomadura madurae Journal of Antibiotics 2004 57 (2) 125-135. DOI: 10.7164/antibiotics.57.125 PMID: 15112961 | ||
| 2 | CNC(CCCN(O)C(=O)CCNC(=O)[C@H](C)NC(=O)C1COC(C2=CC=CC=C2O)=N1)C(=O)N[C@H]1CCCN(O)C1=O | Shaaban, Khaled A.; Saunders, Meredith A.; Zhang, Yinan; Tran, Tuan; Elshahawi, Sherif I.; Ponomareva, Larissa V.; Wang, Xiachang; Zhang, Jianjun; Copley, Gregory C.; Sunkara, Manjula; Kharel, Madan K.; Morris, Andrew J.; Hower, James C.; Tremblay, Matthew S.; Prendergast, Mark A.; Thorson, Jon S. Spoxazomicin D and Oxachelin C, potent neuroprotective carboxamides from the appalachian coal fire-associated isolate Streptomyces sp. RM-14.6 Journal of Natural Products 2017 80 (1) 2-11. DOI: 10.1021/acs.jnatprod.6b00948 PMID: 28029795 | ||
