Chem
J-GLOBAL ID:200907018426287540   Nikkaji number:J135.571F

Neorustmicin B

ネオルストミシンB
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: C21H34O7
Molecular formula furigana: C21-H34-O7
Molecular weight: 398.496
InChI: InChI=1S/C21H34O7/c1-7-16-19(5,24)9-13(2)8-14(3)10-21(26-6)11-20(25,12-27-21)17(22)15(4)18(23)28-16/h9,14-16,24-25H,7-8,10-12H2,1-6H3/t14-,15+,16+,19-,20+,21-/m0/s1
InChI key: JLVZVGQWWZKQQV-OBQBINIZSA-N
SMILES: CC[C@H]1OC(=O)[C@H](C)C(=O)[C@]2(O)CO[C@](C2)(C[C@@H](C)CC(=C[C@]1(C)O)C)OC
Systematic name  (3):
  • 10,11-ジデヒドロ-6-デメチル-9-デオキソ-3,5,11-トリデオキシ-6,17-エポキシ-4-ヒドロキシ-6-O-メチル-3-オキソエリトロノリドA
  • (1R,3R,6R,7S,11S,13S)-6-エチル-1,7-ジヒドロキシ-13-メトキシ-3,7,9,11-テトラメチル-5,14-ジオキサビシクロ[11.2.1]ヘキサデカ-8-エン-2,4-ジオン
  • (1R,3R,6R,7S,11S,13S)-6-ethyl-1,7-dihydroxy-13-methoxy-3,7,9,11-tetramethyl-5,14-dioxabicyclo[11.2.1]hexadec-8-ene-2,4-dione
Other name (4):
  • ネオルストミシンB
  • Neorustmicin B
  • ネオルストマイシンB
  • 10,11-Didehydro-6-demethyl-9-deoxo-3,5,11-trideoxy-6,17-epoxy-4-hydroxy-6-O-methyl-3-oxoerythronolide A
CAS registry number: 104169-53-1
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