Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001307
PROPERTIES
| NPAID | NPA001307 |
|---|---|
| CLUSTER ID | 46 |
| NODE ID | 11 |
| NAME | 11-Hydroxy-aclacinomycin B |
| FORMULA | C42H51NO16 |
| MOLECULAR WEIGHT (Da) | 825.8610 |
| ACCURATE MASS (Da) | 825.3208 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | galilaeus |
| InChIKey | DKXGZTHFCJJLIP-VNRNZZGISA-N |
| InChI | InChI=1S/C42H51NO16/c1-8-42(51)15-25(29-30(33(42)40(50)52-7)37(49)31-32(36(29)48)35(47)28-19(34(31)46)10-9-11-21(28)44)57-26-12-20(43(5)6)38(17(3)53-26)58-27-14-23-39(18(4)54-27)59-41-24(56-23)13-22(45)16(2)55-41/h9-11,16-18,20,23-27,33,38-39,41,44,48-49,51H,8,12-15H2,1-7H3/t16?,17?,18?,20?,23?,24?,25-,26?,27?,33?,38?,39?,41?,42+/m0/s1 |
| SMILES | CC[C@]1(C[C@@H](C2=C(C3=C(C(=C2C1C(=O)OC)O)C(=O)C4=C(C3=O)C(=CC=C4)O)O)OC5CC(C(C(O5)C)OC6CC7C(C(O6)C)OC8C(O7)CC(=O)C(O8)C)N(C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | KIM, HANG-SUB; HONG, YOUNG-SOO; KIM, YOUNG-HO; YOO, OOK-JOON; LEE, JUNG-JOON New Anthracycline Metabolites Produced by the Aklavinone 11-Hydroxylase Gene in Streptomyces galilaeus ATCC 31133 Journal of Antibiotics 1996 49 (4) 355-360. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.49.355 | PMID | 8641998 |
