Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001795
PROPERTIES
| NPAID | NPA001795 |
|---|---|
| CLUSTER ID | 158 |
| NODE ID | 149 |
| NAME | Kigamicin E |
| FORMULA | C55H71NO22 |
| MOLECULAR WEIGHT (Da) | 1098.1580 |
| ACCURATE MASS (Da) | 1097.4468 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Amycolatopsis |
| ORIGIN SPECIES | sp. ML630-mF1 |
| InChIKey | HSNNYVGQDKCUKD-UHFFFAOYSA-N |
| InChI | InChI=1S/C55H71NO22/c1-21-28(74-35-17-32(65-7)49(23(3)72-35)77-37-18-33(66-8)50(24(4)73-37)76-36-16-30(64-6)44(58)22(2)71-36)9-10-34(70-21)75-31-15-27(57)40-47(61)43-48(62)42-38-25(13-26-19-55(5)56(11-12-69-55)54(63)39(26)46(38)60)14-29-41(42)52(68-20-67-29)53(43)78-51(40)45(31)59/h13,21-24,27-37,44-45,49-50,57-60,62H,9-12,14-20H2,1-8H3 |
| SMILES | CC1C(CCC(O1)OC2CC(C3=C(C2O)OC4=C(C3=O)C(=C5C6=C4OCOC6CC7=CC8=C(C(=C75)O)C(=O)N9CCOC9(C8)C)O)O)OC1CC(C(C(O1)C)OC1CC(C(C(O1)C)OC1CC(C(C(O1)C)O)OC)OC)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kunimoto, Setsuko; Lu, Jie; Esumi, Hiroyasu; Yamazaki, Yohko; Kinoshita, Naoko; Honma, Yoshiko; Hamada, Masa; Ohsono, Michiyo; Ishizuka, Masaaki; Takeuchi, Tomio Kigamicins, novel antitumor antibiotics. I. Taxonomy, isolation, physico-chemical properties and biological activities Journal of Antibiotics 2003 56 (12) 1004-1011. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.56.1004 | PMID | 15015727 |
