Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018200
PROPERTIES
NPAID | NPA018200 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Astraeusin I |
FORMULA | C31H48O3 |
MOLECULAR WEIGHT (Da) | 468.7220 |
ACCURATE MASS (Da) | 468.3603 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Astraeus |
ORIGIN SPECIES | odoratus |
InChIKey | HJTGQORBOJNTSC-CNYNGXNLSA-N |
InChI | InChI=1S/C31H48O3/c1-19-9-11-24(34-27(19)33-8)20(2)21-13-17-31(7)23-10-12-25-28(3,4)26(32)15-16-29(25,5)22(23)14-18-30(21,31)6/h9,20-21,24-25,27H,10-18H2,1-8H3/t20-,21+,24-,25-,27-,29+,30+,31-/m0/s1 |
SMILES | CC1=CC[C@H](O[C@@H]1OC)[C@@H](C)[C@H]2CC[C@@]3([C@@]2(CCC4=C3CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Isaka, Masahiko; Palasarn, Somporn; Srikitikulchai, Prasert; Vichai, Vanicha; Komwijit, Somjit Astraeusins A-L, lanostane triterpenoids from the edible mushroom Astraeus odoratus Tetrahedron 2016 72 (23) 3288-3295. | ||
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DOI | 10.1016/j.tet.2016.04.057 | PMID | - |