Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015702
PROPERTIES
| NPAID | NPA015702 |
|---|---|
| CLUSTER ID | 2184 |
| NODE ID | 1740 |
| NAME | Favolon |
| FORMULA | C33H50O9 |
| MOLECULAR WEIGHT (Da) | 590.7540 |
| ACCURATE MASS (Da) | 590.3455 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Favolaschia |
| ORIGIN SPECIES | sp. 87129 |
| InChIKey | SDVHFMSSWIIGCL-ASDINTJWSA-N |
| InChI | InChI=1S/C33H50O9/c1-15(2)16(3)23(34)24(35)17(4)19-9-10-20-22-25(36)27-32(42-27)13-18(40-28(38)26(37)29(5,6)39)11-12-31(32,8)33(22)21(41-33)14-30(19,20)7/h15-23,26-27,34,37,39H,9-14H2,1-8H3/t16-,17+,18+,19-,20+,21-,22+,23+,26+,27-,30-,31+,32-,33-/m1/s1 |
| SMILES | CC(C)[C@@H](C)[C@H](O)C(=O)[C@@H](C)[C@H]1CC[C@H]2[C@H]3C(=O)[C@H]4O[C@]45C[C@@H](OC(=O)[C@H](O)C(C)(C)O)CC[C@]5(C)[C@]34O[C@@H]4C[C@]12C |
ORIGINAL ISOLATION REFERENCE
| CITATION | ANKE, TIMM; WERLE, ANDREAS; ZAPF, SYLVIA; VELTEN, ROBERT; STEGLICH, WOLFGANG Favolon, a New Antifungal Triterpenoid from a Favolaschia Species Journal of Antibiotics 1995 48 (7) 725-726. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.48.725 | PMID | 7649875 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | C[C@@H]([C@H]1CC[C@@H]2[C@@]1(C[C@@H]3[C@]4([C@@H]2C(=O)[C@H]5[C@@]6([C@@]4(CC[C@@H](C6)OC(=O)C(C(C)(C)O)O)C)O5)O3)C)C(=O)C(C(C)C(C)C)O | ANKE, TIMM; WERLE, ANDREAS; ZAPF, SYLVIA; VELTEN, ROBERT; STEGLICH, WOLFGANG Favolon, a New Antifungal Triterpenoid from a Favolaschia Species Journal of Antibiotics 1995 48 (7) 725-726. DOI: 10.7164/antibiotics.48.725 PMID: 7649875 | ||
| 2 | CC(C)[C@@H](C)[C@H](O)C(=O)[C@@H](C)[C@H]1CC[C@H]2[C@H]3C(=O)[C@H]4O[C@]45C[C@@H](OC(=O)[C@H](O)C(C)(C)O)CC[C@]5(C)[C@]34O[C@@H]4C[C@]12C | Palasarn, Somporn; Intereya, Kamolphan; Boonpratuang, Thitiya; Thongpanchang, Chawanee; Isaka, Masahiko Ergostane triterpenoids from the cultures of basidiomycete Favolaschia calocera BCC 36684 and stereochemical elucidation of favolon Phytochemistry Letters 2022 47 168-173. DOI: 10.1016/j.phytol.2022.01.002 | ||
