Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016053
PROPERTIES
NPAID | NPA016053 |
---|---|
CLUSTER ID | 1986 |
NODE ID | 390 |
NAME | WS 79089C |
FORMULA | C29H22O10 |
MOLECULAR WEIGHT (Da) | 530.4850 |
ACCURATE MASS (Da) | 530.1213 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptosporangium |
ORIGIN SPECIES | roseum. NO. 79089 |
InChIKey | KPZZVJIBEBNPBQ-UHFFFAOYSA-N |
InChI | InChI=1S/C29H22O10/c1-10-7-12-8-13-9-16(39-11(2)30)20-21(17(13)25(33)18(12)29(36)38-10)27(35)22-23(28(20)37-3)26(34)19-14(24(22)32)5-4-6-15(19)31/h4-6,8,10,16,31,33,35H,7,9H2,1-3H3 |
SMILES | CC1CC2=C(C(=C3C(=C2)CC(C4=C3C(=C5C(=C4OC)C(=O)C6=C(C5=O)C=CC=C6O)O)OC(=O)C)O)C(=O)O1 |
ORIGINAL ISOLATION REFERENCE
CITATION | Tsurumi; Ohhata; Iwamoto; Shigematsu; Sakamoto; Nishikawa; Kiyoto; Okuhara WS79089A, B and C, new endothelin converting enzyme inhibitors isolated from Streptosporangium roseum. NO. 79089: Taxonomy, fermentation, isolation, physico-chemical properties and biological activities Journal of Antibiotics 1994 47 (6) 619-630. | ||
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DOI | 10.7164/antibiotics.47.619 | PMID | 8040066 |