Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA021283
PROPERTIES
| NPAID | NPA021283 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | Obelmycin D |
| FORMULA | C60H88N2O23 |
| MOLECULAR WEIGHT (Da) | 1205.3550 |
| ACCURATE MASS (Da) | 1204.5778 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | violaceus |
| InChIKey | NWSULKNDMBRCNS-NSBUQMFKSA-N |
| InChI | InChI=1S/C60H88N2O23/c1-12-60(73)23-38(80-41-19-30(61(8)9)55(26(4)76-41)83-43-21-36(67)57(28(6)78-43)81-39-17-15-32(63)24(2)74-39)47-50(54(72)49-48(53(47)71)51(69)45-34(65)13-14-35(66)46(45)52(49)70)59(60)85-42-20-31(62(10)11)56(27(5)77-42)84-44-22-37(68)58(29(7)79-44)82-40-18-16-33(64)25(3)75-40/h13-14,24-33,36-44,55-59,63-68,71-73H,12,15-23H2,1-11H3/t24-,25+,26+,27-,28-,29+,30+,31+,32-,33-,36-,37+,38-,39-,40-,41-,42-,43+,44-,55-,56-,57+,58-,59-,60+/m0/s1 |
| SMILES | CC[C@]1(C[C@@H](C2=C(C3=C(C(=C2[C@@H]1O[C@H]4C[C@H]([C@H]([C@@H](O4)C)O[C@H]5C[C@H]([C@H]([C@H](O5)C)O[C@H]6CC[C@@H]([C@H](O6)C)O)O)N(C)C)O)C(=O)C7=C(C=CC(=C7C3=O)O)O)O)O[C@H]8C[C@H]([C@H]([C@H](O8)C)O[C@@H]9C[C@@H]([C@@H]([C@@H](O9)C)O[C@H]1CC[C@@H]([C@@H](O1)C)O)O)N(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Johdo O; Ishikura T; Yoshimoto A; Takeuchi T Anthracycline metabolites from Streptomyces violaceus A262. I. Isolation of antibiotic-blocked mutants from Streptomyces violaceus A262. Journal of Antibiotics 1991 44 (10) 1110-1120. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.44.1110 | PMID | 1955394 |
