Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA007292
PROPERTIES
NPAID | NPA007292 |
---|---|
CLUSTER ID | 376 |
NODE ID | 340 |
NAME | Decaturin C |
FORMULA | C30H35NO5 |
MOLECULAR WEIGHT (Da) | 489.6120 |
ACCURATE MASS (Da) | 489.2515 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | thiersii (MYC-500 ) NRRL 28147 |
InChIKey | VVYVYDOUCPUFSI-XHVWOXFNSA-N |
InChI | InChI=1S/C30H35NO5/c1-18-7-8-24-27(4,10-9-23-26(2,3)30(33)12-11-28(23,24)17-34-30)29(18)15-20-22(36-29)14-21(35-25(20)32)19-6-5-13-31-16-19/h5-7,13-14,16,23-24,33H,8-12,15,17H2,1-4H3/t23-,24-,27+,28+,29-,30-/m0/s1 |
SMILES | CC1=CC[C@H]2[C@]([C@]13CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)(CC[C@@H]6[C@]27CC[C@@](C6(C)C)(OC7)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Li, Chen; Gloer, James B.; Wicklow, Donald T.; Dowd, Patrick F. Antiinsectan decaturin and oxalicine analogues from Penicillium thiersii Journal of Natural Products 2005 68 (3) 319-322. | ||
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DOI | 10.1021/np0496486 | PMID | 15787428 |