Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011643
PROPERTIES
| NPAID | NPA011643 |
|---|---|
| CLUSTER ID | 206 |
| NODE ID | 193 |
| NAME | Adxanthromycin B |
| FORMULA | C48H50O22 |
| MOLECULAR WEIGHT (Da) | 978.9060 |
| ACCURATE MASS (Da) | 978.2794 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. NA-148 |
| InChIKey | MVIOXXHCLPZAAQ-DCWUOCOFSA-N |
| InChI | InChI=1S/C48H50O22/c1-15-7-9-19-31(33(15)52)36(55)27-17(3)29(43(61)62)23(51)11-21(27)47(19,5)69-70-48(6)20-10-8-16(2)34(53)32(20)37(56)28-18(4)30(44(63)64)24(12-22(28)48)65-45-41(60)39(58)42(26(14-50)67-45)68-46-40(59)38(57)35(54)25(13-49)66-46/h7-12,25-26,35,38-42,45-46,49-54,57-60H,13-14H2,1-6H3,(H,61,62)(H,63,64)/t25-,26-,35+,38+,39-,40-,41-,42+,45+,46-,47+,48+/m0/s1 |
| SMILES | CC1=C(C2=C(C=C1)[C@@](C3=CC(=C(C(=C3C2=O)C)C(=O)O)O)(C)OO[C@@]4(C5=C(C(=C(C=C5)C)O)C(=O)C6=C(C(=C(C=C64)O[C@H]7[C@H]([C@@H]([C@@H]([C@@H](O7)CO)O[C@H]8[C@H]([C@@H]([C@@H]([C@@H](O8)CO)O)O)O)O)O)C(=O)O)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Nakano, Takayuki; Koiwa, Tsukasa; Takahashi, Senji; Nakagawa, Akira Adxanthromycins A and B, new inhibitors of ICAM-1/LFA-1 mediated cell adhesion molecule from Streptomyces sp. NA-148 I. Taxonomy, production, isolation and biological activities Journal of Antibiotics 2000 53 (1) 12-18. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.53.12 | PMID | 10724002 |
