记录说明
(1~{S},3'~{R},4~{a}~{S},7~{a}~{S})-3-[(6-methoxy-2,8-dimethyl-chroman-2-yl)methyl]-2',2',4~{a},7~{a}-tetramethyl-spiro[6,7-dihydro-5~{H}-cyclopenta[c]pyran-1,5'-tetrahydrofuran]-3' 收自 NPASS。关联生物包括 Cystophora fibrosa。
C28H40O5
式量由分子式和标准同位素质量计算,456.287574。
(1~{S},3'~{R},4~{a}~{S},7~{a}~{S})-3-[(6-methoxy-2,8-dimethyl-chroman-2-yl)methyl]-2',2',4~{a},7~{a}-tetramethyl-spiro[6,7-dihydro-5~{H}-cyclopenta[c]pyran-1,5'-tetrahydrofuran]-3' 收自 NPASS。关联生物包括 Cystophora fibrosa。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
COC1=CC(C)=C2OC(C)(CC3=C[C@]4(C)CCC[C@]4(C)[C@@]4(C[C@@H](O)C(C)(C)O4)O3)CCC2=C1
InChIKey
GKTCAZZZORZSFL-KJYGRUAZSA-N
IUPAC
(1~{S},3'~{R},4~{a}~{S},7~{a}~{S})-3-[(6-methoxy-2,8-dimethyl-chroman-2-yl)methyl]-2',2',4~{a},7~{a}-tetramethyl-spiro[6,7-dihydro-5~{H}-cyclopenta[c]pyran-1,5'-tetrahydrofuran]-3'-ol