Chem
J-GLOBAL ID:200907027615171714   Nikkaji number:J2.490.315J

(3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-8,10,14,20-Tetrahydroxy-7,13,15,17,21-pentamethyl-22-[(1S,2Z)-1-methyl-2,4-pentadienyl]-1-oxa-3,5,11-cyclodocosatriene-2-one

(3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-22-[(2S,3Z)-ヘキサ-3,5-ジエン-2-イル]-8,10,14,20-テトラヒドロキシ-7,13,15,17,21-ペンタメチル-1-オキサシクロドコサ-3,5,11-トリエン-2-オン
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: C32H52O6
Molecular formula furigana: C32-H52-O6
Molecular weight: 532.762
InChI: InChI=1S/C32H52O6/c1-8-9-12-24(5)32-26(7)28(34)18-15-21(2)19-25(6)31(37)23(4)16-17-27(33)20-29(35)22(3)13-10-11-14-30(36)38-32/h8-14,16-17,21-29,31-35,37H,1,15,18-20H2,2-7H3/b12-9-,13-10+,14-11-,17-16-/t21-,22+,23+,24+,25+,26+,27?,28-,29+,31?,32+/m1/s1
InChI key: OFPZNTXZCGKCMU-NTNVCDJJSA-N
SMILES: C[C@@H](/C=C\C=C)[C@@H]1OC(=O)/C=C\C=C\[C@H](C)[C@@H](O)CC(O)/C=C\[C@H](C)C(O)[C@@H](C)C[C@H](C)CC[C@@H](O)[C@@H]1C
Systematic name  (3):
  • (3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-8,10,14,20-テトラヒドロキシ-7,13,15,17,21-ペンタメチル-22-[(1S,2Z)-1-メチル-2,4-ペンタジエニル]-1-オキサ-3,5,11-シクロドコサトリエン-2-オン
  • (3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-22-[(2S,3Z)-ヘキサ-3,5-ジエン-2-イル]-8,10,14,20-テトラヒドロキシ-7,13,15,17,21-ペンタメチル-1-オキサシクロドコサ-3,5,11-トリエン-2-オン
  • (3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-22-[(2S,3Z)-hexa-3,5-dien-2-yl]-8,10,14,20-tetrahydroxy-7,13,15,17,21-pentamethyl-1-oxacyclodocosa-3,5,11-trien-2-one
Other name (1):
  • (3Z,5E,7S,8S,10S,11Z,13S,15S,17R,20R,21S,22S)-8,10,14,20-Tetrahydroxy-7,13,15,17,21-pentamethyl-22-[(1S,2Z)-1-methyl-2,4-pentadienyl]-1-oxa-3,5,11-cyclodocosatriene-2-one
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