Chem
J-GLOBAL ID:200907033417887100   Nikkaji number:J2.606.556I

(9R)-9-Hydroxy-10-oxo-11-[(3R)-3α,7-dihydroxy-4α-[(Z)-2-pentenyl]-3a,7β-methano-1,2,3,3a,4,5,7,8-octahydro-6-oxa-1-aza-6H-cyclopentacyclooctene-5α-yl]undecanoic acid

(9R)-11-[(2R,8R,10S,11S)-2,8-ジヒドロキシ-11-[(2Z)-ペンタ-2-エン-1-イル]-9-オキサ-4-アザトリシクロ[6.3.1.01,5]ドデカ-5-エン-10-イル]-9-ヒドロキシ-10-オキソウンデカン酸
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: C26H41NO7
Molecular formula furigana: C26-H41-N-O7
Molecular weight: 479.614
InChI: InChI=1S/C26H41NO7/c1-2-3-7-10-18-21(15-20(29)19(28)11-8-5-4-6-9-12-24(31)32)34-25(33)14-13-22-26(18,17-25)23(30)16-27-22/h3,7,13,18-19,21,23,27-28,30,33H,2,4-6,8-12,14-17H2,1H3,(H,31,32)/b7-3-/t18-,19-,21+,23+,25-,26?/m1/s1
InChI key: GNBHSYHUQZEWGV-NSHJETAGSA-N
SMILES: CC/C=C\C[C@@H]1[C@H](CC(=O)[C@H](O)CCCCCCCC(=O)O)O[C@]2(O)CC=C3NC[C@H](O)C13C2
Systematic name  (3):
  • (9R)-9-ヒドロキシ-10-オキソ-11-[(3R)-3α,7-ジヒドロキシ-4α-[(Z)-2-ペンテニル]-3a,7β-メタノ-1,2,3,3a,4,5,7,8-オクタヒドロ-6-オキサ-1-アザ-6H-シクロペンタシクロオクテン-5α-イル]ウンデカン酸
  • (9R)-11-[(2R,8R,10S,11S)-2,8-ジヒドロキシ-11-[(2Z)-ペンタ-2-エン-1-イル]-9-オキサ-4-アザトリシクロ[6.3.1.01,5]ドデカ-5-エン-10-イル]-9-ヒドロキシ-10-オキソウンデカン酸
  • (9R)-11-[(2R,8R,10S,11S)-2,8-dihydroxy-11-[(2Z)-pent-2-en-1-yl]-9-oxa-4-azatricyclo[6.3.1.01,5]dodec-5-en-10-yl]-9-hydroxy-10-oxoundecanoic acid
Other name (1):
  • (9R)-9-Hydroxy-10-oxo-11-[(3R)-3α,7-dihydroxy-4α-[(Z)-2-pentenyl]-3a,7β-methano-1,2,3,3a,4,5,7,8-octahydro-6-oxa-1-aza-6H-cyclopentacyclooctene-5α-yl]undecanoic acid
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