Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014636
PROPERTIES
| NPAID | NPA014636 |
|---|---|
| CLUSTER ID | 3770 |
| NODE ID | 389 |
| NAME | Hypocrellin A |
| FORMULA | C30H26O10 |
| MOLECULAR WEIGHT (Da) | 546.5280 |
| ACCURATE MASS (Da) | 546.1526 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Shiraia |
| ORIGIN SPECIES | bambusicola |
| InChIKey | VANSZAOQCMTTPB-RNAHPLFWSA-N |
| InChI | InChI=1S/C30H26O10/c1-10(31)25-24-22-16-11(9-30(25,2)36)28(39-5)26(34)17-12(32)7-14(37-3)19(21(16)17)20-15(38-4)8-13(33)18(23(20)22)27(35)29(24)40-6/h7-8,25,34-36H,9H2,1-6H3/t25-,30+/m1/s1 |
| SMILES | CC(=O)[C@@H]1C2=C(C(=C3C(=O)C=C(C4=C5C(=CC(=O)C6=C(C(=C(C[C@]1(C)O)C(=C56)C2=C43)OC)O)OC)OC)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | XY Wan, YT Chen HYPOCRELLIN A-A NEW DRUG FOR PHOTOCHEMOTHERAPY Chinese Science Bulletin 1981 26 (11) 1040-1042. | ||
|---|---|---|---|
| DOI | 10.1360/sb1981-26-11-1040 | PMID | - |
SYNTHESES
| CITATION 1 | O'Brien EM; Morgan BJ; Kozlowski MC Dynamic stereochemistry transfer in a transannular aldol reaction: total synthesis of hypocrellin A. Angewandte Chemie International Edition 2008 47 (36) 6877-80. DOI: 10.1002/anie.200800734 PMID: 18506776 | ||
|---|---|---|---|
| CITATION 2 | O'Brien EM; Morgan BJ; Mulrooney CA; Carroll PJ; Kozlowski MC Perylenequinone natural products: total synthesis of hypocrellin A. Journal of Organic Chemistry 2010 75 (1) 57-68. DOI: 10.1021/jo901386d PMID: 19894741 | ||
