Chem
J-GLOBAL ID:200907081426435241
Nikkaji number:J89.151G
Scirpene
シルペン
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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:
C15 H22 O2
Molecular formula furigana:
C15-H22-O2
Molecular weight:
234.339
InChI:
InChI=1S/C15H22O2/c1-10-4-6-13(2)12(8-10)17-11-5-7-14(13,3)15(11)9-16-15/h8,11-12H,4-7,9H2,1-3H3/t11-,12-,13+,14-,15+/m1/s1
InChI key:
LZAJKCZTKKKZNT-QMIVOQANSA-N
SMILES:
CC1=C[C@H]2O[C@@H]3CC[C@@](C)([C@@]43CO4)[C@@]2(C)CC1
Systematic name (4):
12,13-エポキシトリコテカ-9-エン
12,13-エポキシトリコテカン-9-エン
(1'R,2S,2'R,7'R,9'R)-1',2',5'-トリメチル-8'-オキサスピロ[オキシラン-2,12'-トリシクロ[7.2.1.02,7 ]ドデカン]-5'-エン
(1'R,2S,2'R,7'R,9'R)-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.02,7 ]dodecan]-5'-ene
Other name (5):
12,13-Epoxytrichothec-9-ene
12,13-Epoxytrichothecane-9-ene
シルペン
Scirpene
12,13-エポキシトリコテック-9-エン
CAS registry number:
37133-74-7
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