Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014492
PROPERTIES
| NPAID | NPA014492 |
|---|---|
| CLUSTER ID | 6 |
| NODE ID | 6 |
| NAME | Hibarimicin G |
| FORMULA | C85H112O39 |
| MOLECULAR WEIGHT (Da) | 1757.7920 |
| ACCURATE MASS (Da) | 1756.6781 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Microbispora |
| ORIGIN SPECIES | rosea (TP-A0121) |
| InChIKey | KDLAXKWCMPFSGH-HKWJCSKESA-N |
| InChI | InChI=1S/C85H112O39/c1-14-20-80(104)78(122-45-18-16-41(28(3)112-45)118-49-26-43(90)82(105,32(7)86)34(9)116-49)68(100)71(120-47-24-39(88)60(92)30(5)114-47)38-23-36-22-37-52(62(94)51(36)76(102)84(38,80)107)63(95)56(74(111-13)70(37)109-11)55-64(96)53-54(67(99)73(55)110-12)65(97)57-58(66(53)98)77(103)85(108)59-72(57)124-81(85,21-15-2)79(69(101)75(59)121-48-25-40(89)61(93)31(6)115-48)123-46-19-17-42(29(4)113-46)119-50-27-44(91)83(106,33(8)87)35(10)117-50/h22,28-31,34-35,38-50,59-61,68-69,71-72,75,78-79,88-95,97-98,100-101,104-108H,14-21,23-27H2,1-13H3/t28-,29-,30+,31+,34-,35-,38?,39-,40-,41+,42+,43+,44+,45+,46+,47+,48?,49-,50-,59?,60+,61+,68?,69?,71?,72?,75?,78?,79?,80?,81?,82+,83+,84?,85?/m1/s1 |
| SMILES | CCCC1(C(C(C(C2C1(C(=O)C3=C(C2)C=C4C(=C3O)C(=C(C(=C4OC)OC)C5=C(C(=O)C6=C(C5=O)C(=C7C(=C6O)C8C9C(C(C(C(C9(C7=O)O)(O8)CCC)O[C@H]1CC[C@@H]([C@H](O1)C)O[C@@H]1C[C@@H]([C@@]([C@H](O1)C)(C(=O)C)O)O)O)OC1C[C@H]([C@H]([C@@H](O1)C)O)O)O)OC)O)O)O[C@H]1C[C@H]([C@H]([C@@H](O1)C)O)O)O)O[C@H]1CC[C@@H]([C@H](O1)C)O[C@@H]1C[C@@H]([C@@]([C@H](O1)C)(C(=O)C)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Kajiura, Takayuki; Furumai, Tamotsu; Igarashi, Yasuhiro; Hori, Hiroshi; Higashi, Kazuaki; Ishiyama, Tadayuki; Uramoto, Masakazu; Uehara, Yoshimasa; Oki, Toshikazu Signal transduction inhibitors, hibarimicins A, B, C, D and G produced by Microbispora. I. Taxonomy, fermentation, isolation and physico-chemical and biological properties Journal of Antibiotics 1998 51 (4) 394-401. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.51.394 | PMID | 9630861 |
