Chem
J-GLOBAL ID:200907094132375679
Nikkaji number:J1.467.018A
ZPS-126
ノナン二酸ビス[3-(ステアロイルオキシ)-2,2-ビス[(ステアロイルオキシ)メチル]プロピル]
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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:
C127 H240 O16
Molecular formula furigana:
C127-H240-O16
Molecular weight:
2023.301
InChI:
InChI=1S/C127H240O16/c1-7-13-19-25-31-37-43-49-55-61-67-73-79-86-94-102-118(128)136-110-126(111-137-119(129)103-95-87-80-74-68-62-56-50-44-38-32-26-20-14-8-2,112-138-120(130)104-96-88-81-75-69-63-57-51-45-39-33-27-21-15-9-3)116-142-124(134)108-100-92-85-93-101-109-125(135)143-117-127(113-139-121(131)105-97-89-82-76-70-64-58-52-46-40-34-28-22-16-10-4,114-140-122(132)106-98-90-83-77-71-65-59-53-47-41-35-29-23-17-11-5)115-141-123(133)107-99-91-84-78-72-66-60-54-48-42-36-30-24-18-12-6/h7-117H2,1-6H3
InChI key:
HIIMUYGESBUCIU-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
Systematic name (3):
ノナン二酸ビス[3-(ステアロイルオキシ)-2,2-ビス[(ステアロイルオキシ)メチル]プロピル]
1,9-ビス[3-(オクタデカノイルオキシ)-2,2-ビス[(オクタデカノイルオキシ)メチル]プロピル] ノナンジオアート
1,9-bis[3-(octadecanoyloxy)-2,2-bis[(octadecanoyloxy)methyl]propyl] nonanedioate
Other name (2):
Nonanedioic acid bis[3-(stearoyloxy)-2,2-bis[(stearoyloxy)methyl]propyl] ester
ZPS-126
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