Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009652
PROPERTIES
NPAID | NPA009652 |
---|---|
CLUSTER ID | 3254 |
NODE ID | 660 |
NAME | Okaramine O |
FORMULA | C32H34N4O4 |
MOLECULAR WEIGHT (Da) | 538.6480 |
ACCURATE MASS (Da) | 538.2580 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | simplicissimum ATCC 90288 |
InChIKey | AGEIPFHTGOFAIQ-IYIRQFPTSA-N |
InChI | InChI=1S/C32H34N4O4/c1-6-31(4,5)36-21-14-10-8-12-19(21)32(40)17-22-27(38)34-16-15-30(2,3)26-23(18-11-7-9-13-20(18)33-26)25(37)24(34)28(39)35(22)29(32)36/h6-16,22,24-25,29,33,37,40H,1,17H2,2-5H3/b16-15-/t22-,24-,25-,29-,32-/m0/s1 |
SMILES | CC1(/C=C\N2[C@@H]([C@H](C3=C1NC4=CC=CC=C43)O)C(=O)N5[C@H](C2=O)C[C@]6([C@@H]5N(C7=CC=CC=C76)C(C)(C)C=C)O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Shiono, Y; Akiyama, K; Hayashi, H Okaramines N, O, P, Q and R, new okaramine congeners, from Penicillium simplicissimum ATCC 90288 Bioscience Biotechnology and Biochemistry 2000 64 (1) 103-110. | ||
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DOI | 10.1271/bbb.64.103 | PMID | 10705454 |