Chem
J-GLOBAL ID：200907058172976970   Nikkaji number：J1.437.976B

γGlu-S-[2-[(2R,3aβ)-2β-(2,4-Dimethoxyphenyl)-3α,6β-dimethyl-7aα-formyloctahydrobenzofuran-7α-yl]ethyl]-L-Cys-Gly-OH

γGlu-S-[2-[(2R,3aβ)-2β-(2,4-ジメトキシフェニル)-3α,6β-ジメチル-7aα-ホルミルオクタヒドロベンゾフラン-7α-イル]エチル]-L-Cys-Gly-OH
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： C31H45N3O10S
Molecular formula furigana： C31-H45-N3-O10-S
Molecular weight： 651.770
InChI： InChI=1S/C31H45N3O10S/c1-17-5-8-22-18(2)28(20-7-6-19(42-3)13-25(20)43-4)44-31(22,16-35)21(17)11-12-45-15-24(29(39)33-14-27(37)38)34-26(36)10-9-23(32)30(40)41/h6-7,13,16-18,21-24,28H,5,8-12,14-15,32H2,1-4H3,(H,33,39)(H,34,36)(H,37,38)(H,40,41)/t17-,18-,21+,22+,23+,24+,28-,31-/m1/s1
InChI key： FYLTXASDGVASIQ-RZSLZALNSA-N
SMILES： COc1ccc([C@@H]2O[C@@]3(C=O)[C@@H](CC[C@@H](C)[C@@H]3CCSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)[C@H]2C)c(OC)c1
Systematic name  (3)：
  • γGlu-S-[2-[(2R,3aβ)-2β-(2,4-ジメトキシフェニル)-3α,6β-ジメチル-7aα-ホルミルオクタヒドロベンゾフラン-7α-イル]エチル]-L-Cys-Gly-OH
  • (2S)-4-{[(1R)-2-({2-[(2R,3R,3aS,6R,7S,7aR)-2-(2,4-ジメトキシフェニル)-7a-ホルミル-3,6-ジメチル-オクタヒドロ-1-ベンゾフラン-7-イル]エチル}スルファニル)-1-[(カルボキシメチル)カルバモイル]エチル]カルバモイル}-2-アミノブタン酸
  • (2S)-4-{[(1R)-2-({2-[(2R,3R,3aS,6R,7S,7aR)-2-(2,4-dimethoxyphenyl)-7a-formyl-3,6-dimethyl-octahydro-1-benzofuran-7-yl]ethyl}sulfanyl)-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}-2-aminobutanoic acid
Other name (1)：
  • γGlu-S-[2-[(2R,3aβ)-2β-(2,4-Dimethoxyphenyl)-3α,6β-dimethyl-7aα-formyloctahydrobenzofuran-7α-yl]ethyl]-L-Cys-Gly-OH
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM