Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA015096
PROPERTIES
NPAID | NPA015096 |
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CLUSTER ID | 5303 |
NODE ID | 3781 |
NAME | 3α,5α,8β-trihydroxycleistanth-13(17),15-dien-18-oic acid |
FORMULA | C20H30O5 |
MOLECULAR WEIGHT (Da) | 350.4550 |
ACCURATE MASS (Da) | 350.2093 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Albatrellus |
ORIGIN SPECIES | confluens |
InChIKey | MECXSJIILFRSID-XSINAMBDSA-N |
InChI | InChI=1S/C20H30O5/c1-5-13-12(2)6-7-14-17(3)9-8-15(21)18(4,16(22)23)20(17,25)11-10-19(13,14)24/h5,13-15,21,24-25H,1-2,6-11H2,3-4H3,(H,22,23)/t13-,14-,15-,17-,18+,19-,20+/m1/s1 |
SMILES | C[C@]12CC[C@H]([C@@]([C@@]1(CC[C@@]3([C@@H]2CCC(=C)[C@H]3C=C)O)O)(C)C(=O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Zhou, Zhong-Yu; Liu, Rong; Jiang, Meng-Yuan; Zhang, Ling; Niu, Yun; Zhu, Ying-Cheng; Dong, Ze-Jun; Liu, Ji-Kai Two new cleistanthane diterpenes and a new isocoumarine from cultures of the basidiomycete Albatrellus confluens Chemical and Pharmaceutical Bulletin 2009 57 (9) 975-978. | ||
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DOI | 10.1248/cpb.57.975 | PMID | 19721259 |