Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022072
PROPERTIES
| NPAID | NPA022072 |
|---|---|
| CLUSTER ID | 164 |
| NODE ID | 155 |
| NAME | Actinomycin Y8 |
| FORMULA | C61H82N12O18 |
| MOLECULAR WEIGHT (Da) | 1271.3930 |
| ACCURATE MASS (Da) | 1270.5870 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. strain Gö-GS12 |
| InChIKey | XATRISMANZEMDH-GIYVJPTOSA-N |
| InChI | InChI=1S/C61H82N12O18/c1-24(2)41-57(84)72-21-33(74)20-35(72)56(83)68(13)22-37(76)70(15)30(10)60(87)89-31(11)44(55(82)64-41)67-53(80)39-40(62)49(78)29(9)51-46(39)63-45-34(18-17-27(7)50(45)91-51)52(79)66-43-32(12)90-61(88)47(26(5)6)71(16)38(77)23-69(14)59(86)48-36(75)19-28(8)73(48)58(85)42(25(3)4)65-54(43)81/h17-18,24-26,28,30-32,35-36,41-44,47-48,75H,19-23,62H2,1-16H3,(H,64,82)(H,65,81)(H,66,79)(H,67,80)/t28-,30-,31+,32+,35-,36-,41+,42+,43-,44-,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)C)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 |
