Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017354
PROPERTIES
| NPAID | NPA017354 |
|---|---|
| CLUSTER ID | 69 |
| NODE ID | 64 |
| NAME | Saponaceol A |
| FORMULA | C46H69NO11 |
| MOLECULAR WEIGHT (Da) | 812.0540 |
| ACCURATE MASS (Da) | 811.4871 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Tricholoma |
| ORIGIN SPECIES | saponaceum |
| InChIKey | ZEGGEDOMPWZJBY-OJCREALKSA-N |
| InChI | InChI=1S/C46H69NO11/c1-41(2)33-17-16-29-30(22-34(49)46(8)28(19-20-45(29,46)7)27-15-18-35(42(3,4)54)57-39(27)52)44(33,6)23-32(48)38(41)58-37(51)25-43(5,55)24-36(50)47-31(40(53)56-9)21-26-13-11-10-12-14-26/h10-14,27-28,31-35,38-39,48-49,52,54-55H,15-25H2,1-9H3,(H,47,50)/t27-,28-,31?,32-,33+,34+,35-,38+,39?,43?,44-,45+,46+/m1/s1 |
| SMILES | C[C@@]12CC[C@@H]([C@]1([C@H](CC3=C2CC[C@@H]4[C@@]3(C[C@H]([C@@H](C4(C)C)OC(=O)CC(C)(CC(=O)NC(CC5=CC=CC=C5)C(=O)OC)O)O)C)O)C)[C@H]6CC[C@@H](OC6O)C(C)(C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yoshikawa, Kazuko; Kuroboshi, Mina; Ahagon, Seiko; Arihara, Shigenobu Three novel crustulinol esters, saponaceols A - C, from Tricholoma saponaceum Chemical and Pharmaceutical Bulletin 2004 52 (7) 886-888. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.52.886 | PMID | 15256717 |
