Chem
J-GLOBAL ID:200907044369459330
Nikkaji number:J597.683I
(-)-SB-209670
1β-(1,3-ベンゾジオキソール-5-イル)-3β-[2-(2-ヒドロキシ-2-オキソエトキシ)-4-メトキシフェニル]-5-プロポキシインダン-2α-カルボン酸
Download MOL file
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:
C29 H28 O9
Molecular formula furigana:
C29-H28-O9
Molecular weight:
520.534
InChI:
InChI=1S/C29H28O9/c1-3-10-35-18-6-7-19-21(12-18)27(20-8-5-17(34-2)13-23(20)36-14-25(30)31)28(29(32)33)26(19)16-4-9-22-24(11-16)38-15-37-22/h4-9,11-13,26-28H,3,10,14-15H2,1-2H3,(H,30,31)(H,32,33)/t26-,27+,28+/m1/s1
InChI key:
UUAVCCWBNUITBB-PKTNWEFCSA-N
SMILES:
CCCOc1ccc2[C@H]([C@@H]([C@H](c2c1)c1ccc(OC)cc1OCC(=O)O)C(=O)O)c1ccc2OCOc2c1
Systematic name (3):
1β-(1,3-ベンゾジオキソール-5-イル)-3β-[2-(2-ヒドロキシ-2-オキソエトキシ)-4-メトキシフェニル]-5-プロポキシインダン-2α-カルボン酸
(1R,2S,3R)-1-(2H-1,3-ベンゾジオキソール-5-イル)-3-[2-(カルボキシメトキシ)-4-メトキシフェニル]-5-プロポキシ-2,3-ジヒドロ-1H-インデン-2-カルボン酸
(1R,2S,3R)-1-(2H-1,3-benzodioxol-5-yl)-3-[2-(carboxymethoxy)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid
Other name (2):
1β-(1,3-Benzodioxol-5-yl)-3β-[2-(2-hydroxy-2-oxoethoxy)-4-methoxyphenyl]-5-propoxyindan-2α-carboxylic acid
(-)-SB-209670
Thsaurus map:
Return to Previous Page