Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA023608
PROPERTIES
NPAID | NPA023608 |
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CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Piptolinic acid D |
FORMULA | C30H42O4 |
MOLECULAR WEIGHT (Da) | 466.6620 |
ACCURATE MASS (Da) | 466.3083 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Piptoporus |
ORIGIN SPECIES | betulinus |
InChIKey | MBPMNCWCPNRGJT-JLPRQSABSA-N |
InChI | InChI=1S/C30H42O4/c1-18(2)9-8-10-19(26(33)34)25-22(31)17-30(7)21-11-12-23-27(3,4)24(32)14-15-28(23,5)20(21)13-16-29(25,30)6/h9,11,13,19,23,25H,8,10,12,14-17H2,1-7H3,(H,33,34)/t19-,23+,25+,28-,29-,30+/m1/s1 |
SMILES | CC(=CCC[C@H]([C@H]1C(=O)C[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)C(=O)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Tohtahon, Zeynep; Xue, Jingjing; Han, Jianxin; Liu, Yushuang; Hua, Huiming; Yuan, Tao Cytotoxic lanostane triterpenoids from the fruiting bodies of Piptoporus betulinus Phytochemistry 2017 143 98-103. | ||
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DOI | 10.1016/j.phytochem.2017.07.013 | PMID | 28800422 |