1,4.07,11.017,24.018,23.011,25]ペンタコサン-15,6'-ペンタシクロ[9.6.1.01,14.04,18.07,11]オクタデカン]-13',18,20,22-テトラエン-4-イウム-4-オラート" Detailed information of the J-GLOBAL is an information service managed by the Japan Science and Technology Agency (hereinafter referred to as "JST"). It provides free access to secondary information on researchers, articles, patents, etc., in science and technology, medicine and pharmacy. The search results guide you to high-quality primary information inside and outside JST.'>
Chem
J-GLOBAL ID：202007016622703981   Nikkaji number：J3.746.005B

(1R,1'R,7S,7'S,11R,11'R,13R,15S,17'Z,18'R,24R,25S)-17'-エチリデン-24-ヒドロキシ-19-メトキシ-13'-(メトキシカルボニル)-16'-メチリデン-8,8'-ジオキサ-4,4',15',17-テトラアザスピロ[ヘプタシクロ[11.10.1.11,4.07,11.017,24.018,23.011,25]ペンタコサン-15,6'-ペンタシクロ[9.6.1.01,14.04,18.07,11]オクタデカン]-13',18,20,22-テトラエン-4-イウム-4-オラート

(1R,1'R,7S,7'S,11R,11'R,13R,15S,17'Z,18'R,24R,25S)-17'-エチリデン-24-ヒドロキシ-19-メトキシ-13'-(メトキシカルボニル)-16'-メチリデン-8,8'-ジオキサ-4,4',15',17-テトラアザスピロ[ヘプタシクロ[11.10.1.11,4.07,11.017,24.018,23.011,25]ペンタコサン-15,6'-ペンタシクロ[9.6.1.01,14.04,18.07,11]オクタデカン]-13',18,20,22-テトラエン-4-イウム-4-オラート
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： C42H52N4O7
Molecular formula furigana： C42-H52-N4-O7
Molecular weight： 724.899
InChI： InChI=1S/C42H52N4O7/c1-5-27-24(2)43-32-26(33(47)51-4)21-39-13-18-53-36(39)37(22-44-14-10-40(27,32)34(39)44)19-25-20-38-12-17-52-30(38)9-15-46(49)16-11-41(35(38)46)28-7-6-8-29(50-3)31(28)45(23-37)42(25,41)48/h5-8,25,30,34-36,43,48H,2,9-23H2,1,3-4H3/b27-5+/t25-,30+,34+,35+,36+,37+,38-,39+,40+,41-,42-,46?/m1/s1
InChI key： OZHWXEDRVLFUQV-GHIRXTJUSA-N
SMILES： COC(=O)C1=C2NC(=C)/C(=C\C)/[C@]32CCN2C[C@]4(C[C@@H]5C[C@]67CCO[C@H]6CC[N+]6(CC[C@]8([C@H]76)c6cccc(OC)c6N(C4)[C@@]58O)[O-])[C@@H]4OCC[C@]4(C1)[C@@H]32
Systematic name  (2)：
  • (1R,1'R,7S,7'S,11R,11'R,13R,15S,17'Z,18'R,24R,25S)-17'-エチリデン-24-ヒドロキシ-19-メトキシ-13'-(メトキシカルボニル)-16'-メチリデン-8,8'-ジオキサ-4,4',15',17-テトラアザスピロ[ヘプタシクロ[11.10.1.11,4.07,11.017,24.018,23.011,25]ペンタコサン-15,6'-ペンタシクロ[9.6.1.01,14.04,18.07,11]オクタデカン]-13',18,20,22-テトラエン-4-イウム-4-オラート
  • (1R,1'R,7S,7'S,11R,11'R,13R,15S,17'Z,18'R,24R,25S)-17'-ethylidene-24-hydroxy-19-methoxy-13'-(methoxycarbonyl)-16'-methylidene-8,8'-dioxa-4,4',15',17-tetraazaspiro[heptacyclo[11.10.1.11,4.07,11.017,24.018,23.011,25]pentacosane-15,6'-pentacyclo[9.6.1.01,14.04,18.07,11]octadecane]-13',18,20,22-tetraen-4-ium-4-olate
Thsaurus map：
Thesaurus Map

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