Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007259
PROPERTIES
| NPAID | NPA007259 |
|---|---|
| CLUSTER ID | 338 |
| NODE ID | 306 |
| NAME | 1-Hydroxycrisamicin A |
| FORMULA | C32H22O12 |
| MOLECULAR WEIGHT (Da) | 598.5160 |
| ACCURATE MASS (Da) | 598.1111 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Micromonospora |
| ORIGIN SPECIES | sp. SA-246 |
| InChIKey | IPAXVRZEFNMCLP-VNURBRLDSA-N |
| InChI | InChI=1S/C32H22O12/c1-9-21-25(31-17(41-9)7-19(35)43-31)29(39)23-13(27(21)37)3-11(5-15(23)33)12-4-14-24(16(34)6-12)30(40)26-22(28(14)38)10(2)42-18-8-20(36)44-32(18)26/h3-6,9-10,17-18,31-34H,7-8H2,1-2H3/t9-,10-,17-,18+,31+,32+/m0/s1 |
| SMILES | C[C@@H]1O[C@H]2CC(=O)O[C@H]2C2=C1C(=O)C1=C(C2=O)C(O)=CC(C2=CC3=C(C(=O)C4=C(C3=O)[C@H](C)O[C@@H]3CC(=O)O[C@@H]43)C(O)=C2)=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yeo, W H; Lee, O K; Yun, B S; Yoo, J S; Kim, Y K; Park, E K; Kim, S S; Kim, Y H; Kim, S K; Yoo, I D; Whang, K S; Yu, S H; Woo, J S 1-Hydroxycrisamicin A, a new isochromanquinone antibacterial antibiotic, produced by Micromonospora sp. SA246 Journal of Antibiotics 1998 51 (1) 82-84. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.51.82 | PMID | 9531992 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | CC1C2=C(C3C(O1)CC(=O)O3)C(=O)C4=C(C2=O)C=C(C=C4O)C5=CC6=C(C(=C5)O)C(=O)C7=C(C6=O)C(OC8C7OC(=O)C8)(C)O | Yeo, W H; Lee, O K; Yun, B S; Yoo, J S; Kim, Y K; Park, E K; Kim, S S; Kim, Y H; Kim, S K; Yoo, I D; Whang, K S; Yu, S H; Woo, J S 1-Hydroxycrisamicin A, a new isochromanquinone antibacterial antibiotic, produced by Micromonospora sp. SA246 Journal of Antibiotics 1998 51 (1) 82-84. DOI: 10.7164/antibiotics.51.82 PMID: 9531992 | ||
| 2 | C[C@@H]1O[C@H]2CC(=O)O[C@H]2C2=C1C(=O)C1=C(C2=O)C(O)=CC(C2=CC3=C(C(=O)C4=C(C3=O)[C@H](C)O[C@@H]3CC(=O)O[C@@H]43)C(O)=C2)=C1 | Kopp, Julia; Brückner, Reinhard Stereoselective Total Synthesis of the Dimeric Naphthoquinonopyrano-γ-lactone (-)-Crisamicin A: Introducing the Dimerization Site by a Late-Stage Hartwig Borylation. Organic Letters 2020 22 (9) 3607-3612. DOI: 10.1021/acs.orglett.0c01078 PMID: 32298125 | ||
