Chem
J-GLOBAL ID：200907029532323914
Nikkaji number：J1.914.449F
N,N-Bis[3-oxo-3-[2-[bis[3-oxo-3-[2-[bis[3-oxo-3-(hexylamino)propyl]amino]ethylamino]propyl]amino]ethylamino]propyl]-1,2-ethanediamine
N,N-ビス[3-オキソ-3-[2-[ビス[3-オキソ-3-[2-[ビス[3-オキソ-3-(ヘキシルアミノ)プロピル]アミノ]エチルアミノ]プロピル]アミノ]エチルアミノ]プロピル]-1,2-エタンジアミン
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： C104H204N22O14
Molecular formula furigana： C104-H204-N22-O14
Molecular weight： 1986.916
InChI：
InChI=1S/C104H204N22O14/c1-9-17-25-33-56-106-91(127)43-72-121(73-44-92(128)107-57-34-26-18-10-2)85-66-116-101(137)51-80-125(81-52-102(138)117-67-86-122(74-45-93(129)108-58-35-27-19-11-3)75-46-94(130)109-59-36-28-20-12-4)89-64-114-99(135)41-70-120(84-55-105)71-42-100(136)115-65-90-126(82-53-103(139)118-68-87-123(76-47-95(131)110-60-37-29-21-13-5)77-48-96(132)111-61-38-30-22-14-6)83-54-104(140)119-69-88-124(78-49-97(133)112-62-39-31-23-15-7)79-50-98(134)113-63-40-32-24-16-8/h9-90,105H2,1-8H3,(H,106,127)(H,107,128)(H,108,129)(H,109,130)(H,110,131)(H,111,132)(H,112,133)(H,113,134)(H,114,135)(H,115,136)(H,116,137)(H,117,138)(H,118,139)(H,119,140)
InChI key：
UTNCXMUDPVAYNK-UHFFFAOYSA-N
SMILES：
CCCCCCNC(=O)CCN(CCNC(=O)CCN(CCNC(=O)CCN(CCN)CCC(=O)NCCN(CCC(=O)NCCN(CCC(=O)NCCCCCC)CCC(=O)NCCCCCC)CCC(=O)NCCN(CCC(=O)NCCCCCC)CCC(=O)NCCCCCC)CCC(=O)NCCN(CCC(=O)NCCCCCC)CCC(=O)NCCCCCC)CCC(=O)NCCCCCC
Systematic name (3)：
- N,N-ビス[3-オキソ-3-[2-[ビス[3-オキソ-3-[2-[ビス[3-オキソ-3-(ヘキシルアミノ)プロピル]アミノ]エチルアミノ]プロピル]アミノ]エチルアミノ]プロピル]-1,2-エタンジアミン
- 3-[(2-アミノエチル)[2-({2-[ビス({2-[(2-{ビス[2-(ヘキシルカルバモイル)エチル]アミノ}エチル)カルバモイル]エチル})アミノ]エチル}カルバモイル)エチル]アミノ]-N-{2-[ビス({2-[(2-{ビス[2-(ヘキシルカルバモイル)エチル]アミノ}エチル)カルバモイル]エチル})アミノ]エチル}プロパンアミド
- 3-[(2-aminoethyl)[2-({2-[bis({2-[(2-{bis[2-(hexylcarbamoyl)ethyl]amino}ethyl)carbamoyl]ethyl})amino]ethyl}carbamoyl)ethyl]amino]-N-{2-[bis({2-[(2-{bis[2-(hexylcarbamoyl)ethyl]amino}ethyl)carbamoyl]ethyl})amino]ethyl}propanamide
- N,N-Bis[3-oxo-3-[2-[bis[3-oxo-3-[2-[bis[3-oxo-3-(hexylamino)propyl]amino]ethylamino]propyl]amino]ethylamino]propyl]-1,2-ethanediamine
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