Chem
J-GLOBAL ID:201807015745634181
Nikkaji number:J3.730.486G
[(9Z,18Z)-18,27-ビス({[(2-メチルプロパ-2-エノイル)オキシ]イミノ})ヘプタシクロ[18.7.0.02,10 .03,8 .011,19 .012,17 .021,26 ]ヘプタコサ-1,4,6,10,13,15,19,22,24-ノナエン-9-イリデン]アミノ2-メチルプロパ-2-エノアート
[(9Z,18Z)-18,27-ビス({[(2-メチルプロパ-2-エノイル)オキシ]イミノ})ヘプタシクロ[18.7.0.02,10 .03,8 .011,19 .012,17 .021,26 ]ヘプタコサ-1,4,6,10,13,15,19,22,24-ノナエン-9-イリデン]アミノ2-メチルプロパ-2-エノアート
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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:
C39 H33 N3 O6
Molecular formula furigana:
C39-H33-N3-O6
Molecular weight:
639.708
InChI:
InChI=1S/C39H33N3O6/c1-19(2)37(43)46-40-34-25-16-10-7-13-22(25)28-31(34)29-23-14-8-11-17-26(23)35(41-47-38(44)20(3)4)33(29)30-24-15-9-12-18-27(24)36(32(28)30)42-48-39(45)21(5)6/h7-18,22-27H,1,3,5H2,2,4,6H3/b40-34-,41-35-,42-36+
InChI key:
CQNJQALBVYSBFD-GBWWQMHYSA-N
SMILES:
c12c3c(c4c(c1/C(=N\OC(=O)C(=C)C)/C1C2C=CC=C1)C1C(C=CC=C1)/C/4=N\OC(=O)C(=C)C)C1C(C=CC=C1)/C/3=N/OC(=O)C(=C)C
Systematic name (2):
[(9Z,18Z)-18,27-ビス({[(2-メチルプロパ-2-エノイル)オキシ]イミノ})ヘプタシクロ[18.7.0.02,10 .03,8 .011,19 .012,17 .021,26 ]ヘプタコサ-1,4,6,10,13,15,19,22,24-ノナエン-9-イリデン]アミノ2-メチルプロパ-2-エノアート
[(9Z,18Z)-18,27-bis({[(2-methylprop-2-enoyl)oxy]imino})heptacyclo[18.7.0.02,10 .03,8 .011,19 .012,17 .021,26 ]heptacosa-1,4,6,10,13,15,19,22,24-nonaen-9-ylidene]amino 2-methylprop-2-enoate
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