Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013520
PROPERTIES
| NPAID | NPA013520 |
|---|---|
| CLUSTER ID | 2302 |
| NODE ID | 473 |
| NAME | Duocarmycin SA |
| FORMULA | C25H23N3O7 |
| MOLECULAR WEIGHT (Da) | 477.4730 |
| ACCURATE MASS (Da) | 477.1536 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | VQNATVDKACXKTF-XELLLNAOSA-N |
| InChI | InChI=1S/C25H23N3O7/c1-32-17-6-11-5-14(26-19(11)22(34-3)21(17)33-2)23(30)28-10-12-9-25(12)13-7-15(24(31)35-4)27-20(13)16(29)8-18(25)28/h5-8,12,26-27H,9-10H2,1-4H3/t12-,25-/m1/s1 |
| SMILES | COC1=C(C(=C2C(=C1)C=C(N2)C(=O)N3C[C@H]4C[C@@]45C3=CC(=O)C6=C5C=C(N6)C(=O)OC)OC)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ichimura, M; Ogawa, T; Katsumata, S; Takahashi, K; Takahashi, I; Nakano, H Duocarmycins, new antitumor antibiotics produced by Streptomyces; producing organisms and improved production Journal of Antibiotics 1991 44 (10) 1045-1053. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.44.1045 | PMID | 1955385 |
