Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022071
PROPERTIES
| NPAID | NPA022071 |
|---|---|
| CLUSTER ID | 164 |
| NODE ID | 155 |
| NAME | Actinomycin Y7 |
| FORMULA | C61H82N12O19 |
| MOLECULAR WEIGHT (Da) | 1287.3920 |
| ACCURATE MASS (Da) | 1286.5819 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. strain Gö-GS12 |
| InChIKey | VWLIXTRHLNPDGZ-JIAPYOCPSA-N |
| InChI | InChI=1S/C61H82N12O19/c1-24(2)41-57(85)72-20-32(75)19-34(72)56(84)68(12)21-37(77)70(14)30(10)60(88)91-36(23-74)45(55(83)64-41)67-53(81)39-40(62)49(79)29(9)51-46(39)63-44-33(17-16-27(7)50(44)92-51)52(80)66-43-31(11)90-61(89)47(26(5)6)71(15)38(78)22-69(13)59(87)48-35(76)18-28(8)73(48)58(86)42(25(3)4)65-54(43)82/h16-17,24-26,28,30-31,34-36,41-43,45,47-48,74,76H,18-23,62H2,1-15H3,(H,64,83)(H,65,82)(H,66,80)(H,67,81)/t28-,30-,31+,34-,35-,36+,41+,42+,43-,45-,47-,48-/m0/s1 |
| SMILES | C[C@H]1C[C@@H]([C@@H]2N1C(=O)[C@H](NC(=O)[C@H]([C@H](OC(=O)[C@@H](N(C(=O)CN(C2=O)C)C)C(C)C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)N[C@H]6[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]7CC(=O)CN7C(=O)[C@H](NC6=O)C(C)C)C)C)C)CO)N)C)C(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cai, Wenlong; Wang, Xiachang; Elshahawi, Sherif I.; Ponomareva, Larissa V.; Liu, Xiaodong; McErlean, Matthew R.; Cui, Zheng; Arlinghaus, Ashley L.; Thorson, Jon S.; Van Lanen, Steven G. Antibacterial and Cytotoxic Actinomycins Y6-Y9 and Zp from Streptomyces sp. Strain Gö-GS12 Journal of Natural Products 2016 79 (10) 2731-2739. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00742 | PMID | 27736087 |
