Chem
J-GLOBAL ID:200907031894836388   Nikkaji number:J705.769E

(+)-Discodermolide

(+)-ジスコデルモリド
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: C33H55NO8
Molecular formula furigana: C33-H55-N-O8
Molecular weight: 593.802
InChI: InChI=1S/C33H55NO8/c1-10-11-12-20(4)31(42-33(34)40)24(8)29(37)22(6)16-18(2)15-21(5)28(36)19(3)13-14-26(35)17-27-23(7)30(38)25(9)32(39)41-27/h10-15,19-31,35-38H,1,16-17H2,2-9H3,(H2,34,40)/b12-11-,14-13-,18-15-/t19-,20-,21-,22-,23-,24-,25+,26+,27-,28-,29+,30-,31-/m0/s1
InChI key: AADVCYNFEREWOS-OBRABYBLSA-N
SMILES: C[C@@H](C/C(=C\[C@H](C)[C@@H](O)[C@@H](C)/C=C\[C@@H](O)C[C@@H]1OC(=O)[C@H](C)[C@@H](O)[C@H]1C)/C)[C@@H](O)[C@H](C)[C@@H](OC(=O)N)[C@@H](C)/C=C\C=C
Systematic name  (4):
  • (2S,3Z,5S,6S,7S,8Z,11S,12R,13S,14S,15S,16Z)-1-[[(2S)-テトラヒドロ-4α-ヒドロキシ-3α,5β-ジメチル-6-オキソ-2H-ピラン]-2β-イル]-5,7,9,11,13,15-ヘキサメチル-3,8,16,18-ノナデカテトラエン-2,6,12,14-テトラオール14-カルバマート
  • (3R)-3α,5β-ジメチル-4β-ヒドロキシ-6α-[(2S,3Z,5S,6S,7S,8Z,11S,12R,13S,14S,15S,16Z)-2,6,12-トリヒドロキシ-5,7,9,11,13,15-ヘキサメチル-14-(カルバモイルオキシ)-3,8,16,18-ノナデカテトラエニル]テトラヒドロ-2H-ピラン-2-オン
  • (3Z,5S,6S,7S,8R,9S,11Z,13S,14S,15S,16Z,18S)-8,14,18-トリヒドロキシ-19-[(2S,3R,4S,5R)-4-ヒドロキシ-3,5-ジメチル-6-オキソオキサン-2-イル]-5,7,9,11,13,15-ヘキサメチルノナデカ-1,3,11,16-テトラエン-6-イル カルバマート
  • (3Z,5S,6S,7S,8R,9S,11Z,13S,14S,15S,16Z,18S)-8,14,18-trihydroxy-19-[(2S,3R,4S,5R)-4-hydroxy-3,5-dimethyl-6-oxooxan-2-yl]-5,7,9,11,13,15-hexamethylnonadeca-1,3,11,16-tetraen-6-yl carbamate
Other name (7):
  • (+)-ジスコデルモリド
  • (+)-Discodermolide
  • (2S,3Z,5S,6S,7S,8Z,11S,12R,13S,14S,15S,16Z)-1-[[(2S)-Tetrahydro-4α-hydroxy-3α,5β-dimethyl-6-oxo-2H-pyran]-2β-yl]-5,7,9,11,13,15-hexamethyl-3,8,16,18-nonadecatetrene-2,6,12,14-tetrol 14-carbamate
  • (+)-ディスコダーモライド
  • Discodermolide
Show all
CAS registry number: 127943-53-7
KEGG COMPOUND: C16746
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