Chem
J-GLOBAL ID:202207000485407890
Nikkaji number:J3.771.080F
(5S,7S)-5-[(2S)-ブタ-3-エン-2-イル]-2,2,3,3,7,13,13-ヘプタメチル-12,12-ジフェニル-4,11-ジオキサ-3,12-ジシラテトラデカン-7-オール
(5S,7S)-5-[(2S)-ブタ-3-エン-2-イル]-2,2,3,3,7,13,13-ヘプタメチル-12,12-ジフェニル-4,11-ジオキサ-3,12-ジシラテトラデカン-7-オール
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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:
C33 H54 O3 Si2
Molecular formula furigana:
C33-H54-O3-SI2
Molecular weight:
554.962
InChI:
InChI=1S/C33H54O3Si2/c1-12-27(2)30(36-37(10,11)31(3,4)5)26-33(9,34)24-19-25-35-38(32(6,7)8,28-20-15-13-16-21-28)29-22-17-14-18-23-29/h12-18,20-23,27,30,34H,1,19,24-26H2,2-11H3/t27-,30-,33-/m0/s1
InChI key:
GLPOUZKVIIUHOB-JIBXKPLWSA-N
SMILES:
C(=C)[C@@H]([C@H](C[C@](O)(C)CCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C
Systematic name (2):
(5S,7S)-5-[(2S)-ブタ-3-エン-2-イル]-2,2,3,3,7,13,13-ヘプタメチル-12,12-ジフェニル-4,11-ジオキサ-3,12-ジシラテトラデカン-7-オール
(5S,7S)-5-[(2S)-but-3-en-2-yl]-2,2,3,3,7,13,13-heptamethyl-12,12-diphenyl-4,11-dioxa-3,12-disilatetradecan-7-ol
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