Chem
J-GLOBAL ID:200907062748878268
Nikkaji number:J161.396K
Fukinotoxin
ペタシテニン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C19 H27 NO7
Molecular formula furigana:
C19-H27-N-O7
Molecular weight:
381.425
InChI:
InChI=1S/C19H27NO7/c1-11-9-19(12(2)27-19)17(23)26-14-6-8-20(4)7-5-13(15(14)21)10-25-16(22)18(11,3)24/h5,11-12,14,24H,6-10H2,1-4H3/t11-,12-,14-,18-,19-/m1/s1
InChI key:
CZQLULNMKQAIQL-WNUXUTQBSA-N
SMILES:
C[C@H]1O[C@@]21C[C@@H](C)[C@@](C)(O)C(=O)OCC1=CCN(C)CC[C@@H](OC2=O)C1=O
Systematic name (4):
(15R,20R)-15,20-エポキシ-15,20-ジヒドロ-12-ヒドロキシ-4-メチル-4,8-セコセネシオナン-8,11,16-トリオン
(15R,20R)-12-ヒドロキシ-15,20-エポキシ-15,20-ジヒドロ-4-メチル-4,8-セコセネシオナン-8,11,16-トリオン
(1R,3'R,4R,6R,7R)-7-ヒドロキシ-3',6,7,14-テトラメチル-2,9-ジオキサ-14-アザスピロ[ビシクロ[9.5.1]ヘプタデカン-4,2'-オキシラン]-11-エン-3,8,17-トリオン
(1R,3'R,4R,6R,7R)-7-hydroxy-3',6,7,14-tetramethyl-2,9-dioxa-14-azaspiro[bicyclo[9.5.1]heptadecane-4,2'-oxiran]-11-ene-3,8,17-trione
Other name (10):
フキノトキシン【中性】
ペタシテニン【中性】
Petasitenine【neutral】
Fukinotoxin【neutral】
(15R,20R)-15,20-Epoxy-15,20-dihydro-12-hydroxy-4-methyl-4,8-secosenecionan-8,11,16-trione
(15R,20R)-12-Hydroxy-15,20-epoxy-15,20-dihydro-4-methyl-4,8-secosenecionan-8,11,16-trione
ペタシテニン
Petasitenine
フキノトキシン
Fukinotoxin
Show all
CAS registry number:
60102-37-6
Regulation number (1):
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