Chem
J-GLOBAL ID：200907045898533470   Nikkaji number：J674.436B

Dynemicin H

ジネマイシンH
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： C30H23NO9
Molecular formula furigana： C30-H23-N-O9
Molecular weight： 541.512
InChI： InChI=1S/C30H23NO9/c1-10-17(29(37)38)27(40-2)18-11-5-3-4-6-12(11)28-30(10,39)23(18)13-9-16(34)21-22(24(13)31-28)26(36)20-15(33)8-7-14(32)19(20)25(21)35/h3-10,18,23,28,31-34,39H,1-2H3,(H,37,38)/t10-,18-,23+,28-,30+/m0/s1
InChI key： SUMIBTQDHCFPDZ-AHCKFAMOSA-N
SMILES： COC1=C([C@H](C)[C@]2(O)[C@H]3Nc4c(cc(O)c5C(=O)c6c(O)ccc(O)c6C(=O)c45)[C@@H]2[C@@H]1c1ccccc31)C(=O)O
Systematic name  (3)：
  • (1S)-1,4,4aα,7,12,13,14,14a-オクタヒドロ-1β-メチル-3-メトキシ-6,8,11,14aα-テトラヒドロキシ-7,12-ジオキソ-4β,14β-[1,2]ベンゼノナフト[2,3-c]フェナントリジン-2-カルボン酸
  • (2S,3R,4S,7R,14S)-3,20,23,27-テトラヒドロキシ-6-メトキシ-4-メチル-18,25-ジオキソ-15-アザヘプタシクロ[14.12.0.02,7.03,14.08,13.017,26.019,24]オクタコサ-1(16),5,8,10,12,17(26),19,21,23,27-デカエン-5-カルボン酸
  • (2S,3R,4S,7R,14S)-3,20,23,27-tetrahydroxy-6-methoxy-4-methyl-18,25-dioxo-15-azaheptacyclo[14.12.0.02,7.03,14.08,13.017,26.019,24]octacosa-1(16),5,8,10,12,17(26),19,21,23,27-decaene-5-carboxylic acid
Other name (3)：
  • ジネマイシンH
  • Dynemicin H
  • (1S)-1,4,4aα,7,12,13,14,14a-Octahydro-1β-methyl-3-methoxy-6,8,11,14aα-tetrahydroxy-7,12-dioxo-4β,14β-[1,2]benzenonaphtho[2,3-c]phenanthridine-2-carboxylic acid
CAS registry number： 129985-03-1
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