Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA004543
PROPERTIES
| NPAID | NPA004543 |
|---|---|
| CLUSTER ID | 710 |
| NODE ID | 621 |
| NAME | Butyrolactone VI |
| FORMULA | C24H24O8 |
| MOLECULAR WEIGHT (Da) | 440.4480 |
| ACCURATE MASS (Da) | 440.1471 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | terreus BCC 4651 |
| InChIKey | ABVQNDITCCCBGM-VCUSLETLSA-N |
| InChI | InChI=1S/C24H24O8/c1-23(2)18(26)11-15-5-4-13(10-17(15)31-23)12-24(22(29)30-3)19(20(27)21(28)32-24)14-6-8-16(25)9-7-14/h4-10,18,25-27H,11-12H2,1-3H3/t18?,24-/m1/s1 |
| SMILES | COC(=O)[C@]1(CC2=CC3=C(C=C2)CC(O)C(C)(C)O3)OC(=O)C(O)=C1C1=CC=C(O)C=C1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Haritakun, Rachada; Rachtawee, Pranee; Chanthaket, Rungtiwa; Boonyuen, Nattawut; Isaka, Masahiko Butyrolactones from the fungus Aspergillus terreus BCC 4651 Chemical and Pharmaceutical Bulletin 2010 58 (11) 1545-1548. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.58.1545 | PMID | 21048353 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | CC(C)(C(CC1=C(C=CC(=C1)C[C@@]2(C(=C(C(=O)O2)O)C3=CC=C(C=C3)O)C(=O)OC)O)O)O | Haritakun, Rachada; Rachtawee, Pranee; Chanthaket, Rungtiwa; Boonyuen, Nattawut; Isaka, Masahiko Butyrolactones from the fungus Aspergillus terreus BCC 4651 Chemical and Pharmaceutical Bulletin 2010 58 (11) 1545-1548. DOI: 10.1248/cpb.58.1545 PMID: 21048353 | ||
| 2 | COC(=O)[C@]1(CC2=CC3=C(C=C2)CC(O)C(C)(C)O3)OC(=O)C(O)=C1C1=CC=C(O)C=C1 | Liu M; Zhou Q; Wang J; Liu J; Qi C; Lai Y; Zhu H; Xue Y; Hu Z; Zhang Y Anti-inflammatory butenolide derivatives from the coral-derived fungus Aspergillus terreus and structure revisions of aspernolides D and G, butyrolactone VI and 4′,8′′-diacetoxy butyrolactone VI RSC Advances 2018 8 (23) 13040-13047. DOI: 10.1039/c8ra01840e | ||
