Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA018549
PROPERTIES
NPAID | NPA018549 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | 2beta-Methoxy-3a,9a-dihydroxyergosta-7,22 |
FORMULA | C29H48O3 |
MOLECULAR WEIGHT (Da) | 444.7000 |
ACCURATE MASS (Da) | 444.3603 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Ganoderma |
ORIGIN SPECIES | amboinense |
InChIKey | AQPFYTGLRKZIIW-DJNFYPBISA-N |
InChI | InChI=1S/C29H48O3/c1-18(2)19(3)8-9-20(4)22-12-13-23-24-11-10-21-16-25(30)26(32-7)17-28(21,6)29(24,31)15-14-27(22,23)5/h8-9,11,18-23,25-26,30-31H,10,12-17H2,1-7H3/b9-8+/t19-,20+,21?,22+,23?,25-,26-,27+,28-,29+/m0/s1 |
SMILES | C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CCC2[C@@]1(CC[C@]3(C2=CCC4[C@@]3(C[C@@H]([C@H](C4)O)OC)C)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chun-Nan, Lin; Shih-Hsieh, Kuo; Shen-Jeu, Won Steroids of formosan Ganoderma amboinense Phytochemistry 1993 32 (6) 1549-1551. | ||
---|---|---|---|
DOI | 10.1016/0031-9422(93)85177-s | PMID | - |