Chem
J-GLOBAL ID：200907092590385168
Nikkaji number：J2.318.197E
3,5-Bis[3,4,5-tris[4-(dodecyloxy)benzyloxy]benzyloxy]benzoic acid 4-(6-hydroxyhexyloxy)phenyl ester
3,5-ビス[3,4,5-トリス[4-(ドデシルオキシ)ベンジルオキシ]ベンジルオキシ]安息香酸4-(6-ヒドロキシヘキシルオキシ)フェニル
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： C147H214O18
Molecular formula furigana： C147-H214-O18
Molecular weight： 2269.311
InChI：
InChI=1S/C147H214O18/c1-7-13-19-25-31-37-43-49-56-64-100-150-131-83-71-122(72-84-131)114-159-141-107-128(108-142(160-115-123-73-85-132(86-74-123)151-101-65-57-50-44-38-32-26-20-14-8-2)145(141)163-118-126-79-91-135(92-80-126)154-104-68-60-53-47-41-35-29-23-17-11-5)120-157-139-111-130(147(149)165-138-97-95-137(96-98-138)156-106-70-62-55-63-99-148)112-140(113-139)158-121-129-109-143(161-116-124-75-87-133(88-76-124)152-102-66-58-51-45-39-33-27-21-15-9-3)146(164-119-127-81-93-136(94-82-127)155-105-69-61-54-48-42-36-30-24-18-12-6)144(110-129)162-117-125-77-89-134(90-78-125)153-103-67-59-52-46-40-34-28-22-16-10-4/h71-98,107-113,148H,7-70,99-106,114-121H2,1-6H3
InChI key：
VENJKZXPNIJAHB-UHFFFAOYSA-N
SMILES：
CCCCCCCCCCCCOc1ccc(COc2cc(COc3cc(OCc4cc(OCc5ccc(OCCCCCCCCCCCC)cc5)c(OCc5ccc(OCCCCCCCCCCCC)cc5)c(OCc5ccc(OCCCCCCCCCCCC)cc5)c4)cc(c3)C(=O)Oc3ccc(OCCCCCCO)cc3)cc(OCc3ccc(OCCCCCCCCCCCC)cc3)c2OCc2ccc(OCCCCCCCCCCCC)cc2)cc1
Systematic name (3)：
- 3,5-ビス[3,4,5-トリス[4-(ドデシルオキシ)ベンジルオキシ]ベンジルオキシ]安息香酸4-(6-ヒドロキシヘキシルオキシ)フェニル
- 4-[(6-ヒドロキシヘキシル)オキシ]フェニル 3,5-ビス({[3,4,5-トリス({[4-(ドデシルオキシ)フェニル]メトキシ})フェニル]メトキシ})ベンゾアート
- 4-[(6-hydroxyhexyl)oxy]phenyl 3,5-bis({[3,4,5-tris({[4-(dodecyloxy)phenyl]methoxy})phenyl]methoxy})benzoate
- 3,5-Bis[3,4,5-tris[4-(dodecyloxy)benzyloxy]benzyloxy]benzoic acid 4-(6-hydroxyhexyloxy)phenyl ester
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