Chem
J-GLOBAL ID：200907032166308304
Nikkaji number：J1.642.198G
(5Z,7S)-7-[(1S)-2α-Hydroxy-2-[(Z)-2-octenyl]-4-iodo-5α-(methoxymethoxy)-3-cyclopentene-1α-yl]-7-hydroxy-5-heptenoic acid methyl ester
(5Z,7S)-7-[(1S)-2α-ヒドロキシ-2-[(Z)-2-オクテニル]-4-ヨード-5α-(メトキシメトキシ)-3-シクロペンテン-1α-イル]-7-ヒドロキシ-5-ヘプテン酸メチル
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
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
Molecular formula： C23H37IO6
Molecular formula furigana： C23-H37-I-O6
Molecular weight： 536.447
InChI：
InChI=1S/C23H37IO6/c1-4-5-6-7-8-12-15-23(27)16-18(24)22(30-17-28-2)21(23)19(25)13-10-9-11-14-20(26)29-3/h8,10,12-13,16,19,21-22,25,27H,4-7,9,11,14-15,17H2,1-3H3/b12-8-,13-10-/t19-,21-,22-,23+/m0/s1
InChI key：
PAYVRXMVHMVLGF-POVCQFLISA-N
SMILES：
CCCCC/C=C\C[C@@]1(O)C=C(I)[C@H](OCOC)[C@@H]1[C@@H](O)/C=C\CCCC(=O)OC
Systematic name (3)：
- (5Z,7S)-7-[(1S)-2α-ヒドロキシ-2-[(Z)-2-オクテニル]-4-ヨード-5α-(メトキシメトキシ)-3-シクロペンテン-1α-イル]-7-ヒドロキシ-5-ヘプテン酸メチル
- メチル (5Z,7S)-7-ヒドロキシ-7-[(1S,2S,5R)-2-ヒドロキシ-4-ヨード-5-(メトキシメトキシ)-2-[(2Z)-オクタ-2-エン-1-イル]シクロペンタ-3-エン-1-イル]ヘプタ-5-エノアート
- methyl (5Z,7S)-7-hydroxy-7-[(1S,2S,5R)-2-hydroxy-4-iodo-5-(methoxymethoxy)-2-[(2Z)-oct-2-en-1-yl]cyclopent-3-en-1-yl]hept-5-enoate
- (5Z,7S)-7-[(1S)-2α-Hydroxy-2-[(Z)-2-octenyl]-4-iodo-5α-(methoxymethoxy)-3-cyclopentene-1α-yl]-7-hydroxy-5-heptenoic acid methyl ester
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