Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA021824
PROPERTIES
NPAID | NPA021824 |
---|---|
CLUSTER ID | 70 |
NODE ID | 65 |
NAME | (22S,24E)-3β,22-7α-methoxy-3β,15α,22-triacetoxylanosta-8,24-dien-26-oic acid |
FORMULA | C37H56O9 |
MOLECULAR WEIGHT (Da) | 644.8460 |
ACCURATE MASS (Da) | 644.3924 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Ganoderma |
ORIGIN SPECIES | sp. BCC 16642 |
InChIKey | GXKWNYCHKLAQPO-KGGJRMPESA-N |
InChI | InChI=1S/C37H56O9/c1-20(33(41)42)12-13-27(44-22(3)38)21(2)26-18-31(46-24(5)40)37(10)32-25(14-17-36(26,37)9)35(8)16-15-30(45-23(4)39)34(6,7)29(35)19-28(32)43-11/h12,21,26-31H,13-19H2,1-11H3,(H,41,42)/b20-12+/t21-,26+,27-,28+,29-,30-,31-,35+,36+,37-/m0/s1 |
SMILES | C[C@@H]([C@H]1C[C@@H]([C@@]2([C@@]1(CCC3=C2[C@@H](C[C@@H]4[C@@]3(CC[C@@H](C4(C)C)OC(=O)C)C)OC)C)C)OC(=O)C)[C@H](C/C=C(\C)/C(=O)O)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Isaka, Masahiko; Chinthanom, Panida; Sappan, Malipan; Danwisetkanjana, Kannawat; Boonpratuang, Thitiya; Choeyklin, Rattaket Antitubercular Lanostane Triterpenes from Cultures of the Basidiomycete Ganoderma sp. BCC 16642 Journal of Natural Products 2016 79 (1) 161-169. | ||
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DOI | 10.1021/acs.jnatprod.5b00826 | PMID | 26716912 |