Chem
J-GLOBAL ID:200907097769484527
Nikkaji number:J9.947C
Coriamyrtin
コリアミルチン
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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 H18 O5
Molecular formula furigana:
C15-H18-O5
Molecular weight:
278.304
InChI:
InChI=1S/C15H18O5/c1-6(2)8-7-4-13(3)14(5-18-14)10-11(20-10)15(13,17)9(8)12(16)19-7/h7-11,17H,1,4-5H2,2-3H3/t7-,8+,9+,10+,11-,13-,14-,15-/m0/s1
InChI key:
BWWDLKVKPVKBGJ-FTCRBNLXSA-N
SMILES:
CC(=C)[C@@H]1[C@@H]2C[C@@]3(C)[C@]4(CO4)[C@@H]4O[C@@H]4[C@@]3(O)[C@H]1C(=O)O2
Systematic name (3):
(7S,8R)-1aβ,1b,5,6,6a,7aβ-ヘキサヒドロ-1bα-ヒドロキシ-6aα-メチル-8-(1-メチルエテニル)スピロ[2α,5α-メタノ-7H-オキシレノ[3,4]シクロペンタ[1,2-d]オキセピン-7,2′-オキシラン]-3(2H)-オン
(1'S,2S,2'R,3'S,5'R,7'R,9'S,12'R)-2'-ヒドロキシ-7'-メチル-12'-(プロパ-1-エン-2-イル)-4',10'-ジオキサスピロ[オキシラン-2,6'-テトラシクロ[7.2.1.02,7 .03,5 ]ドデカン]-11'-オン
(1'S,2S,2'R,3'S,5'R,7'R,9'S,12'R)-2'-hydroxy-7'-methyl-12'-(prop-1-en-2-yl)-4',10'-dioxaspiro[oxirane-2,6'-tetracyclo[7.2.1.02,7 .03,5 ]dodecan]-11'-one
Other name (3):
コリアミルチン
Coriamyrtin
(7S,8R)-1aβ,1b,5,6,6a,7aβ-Hexahydro-1bα-hydroxy-6aα-methyl-8-(1-methylethenyl)spiro[2α,5α-methano-7H-oxireno[3,4]cyclopent[1,2-d]oxepine-7,2′-oxiran]-3(2H)-one
CAS registry number:
2571-86-0
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