Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015515
PROPERTIES
| NPAID | NPA015515 |
|---|---|
| CLUSTER ID | 398 |
| NODE ID | 358 |
| NAME | Cryptophycin-28 |
| FORMULA | C34H41ClN2O7 |
| MOLECULAR WEIGHT (Da) | 625.1620 |
| ACCURATE MASS (Da) | 624.2602 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nostoc |
| ORIGIN SPECIES | sp. GSV 224 |
| InChIKey | YMZVKVLSUBCSND-DWEOSBBHSA-N |
| InChI | InChI=1S/C34H41ClN2O7/c1-22(2)18-30-34(41)43-26(13-8-12-24-10-6-5-7-11-24)14-9-15-31(38)37-28(32(39)36-21-23(3)33(40)44-30)20-25-16-17-29(42-4)27(35)19-25/h5-12,15-17,19,22-23,26,28,30H,13-14,18,20-21H2,1-4H3,(H,36,39)(H,37,38)/b12-8+,15-9+/t23-,26-,28-,30+/m1/s1 |
| SMILES | C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)C/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)OC)Cl |
ORIGINAL ISOLATION REFERENCE
| CITATION | Golakoti, Trimurtulu; Ogino, Junichi; Heltzel, Carl E.; Le Husebo, Trang; Jensen, Craig M.; Larsen, Linda K.; Patterson, Gregory M. L.; Moore, Richard E.; Mooberry, Susan L.; Corbett, Thomas H.; Valeriote, Frederick A. Structure determination, conformational analysis, chemical stability studies, and antitumor evaluation of the cryptophycins. Isolation of 18 new analogs from Nostoc sp. strain GSV 224 Journal of the American Chemical Society 1995 117 (49) 12030-12049. | ||
|---|---|---|---|
| DOI | 10.1021/ja00154a002 | PMID | - |
