Chem
J-GLOBAL ID：200907083175251440   Nikkaji number：J1.561.872H

Porwenin B

ポルウェニン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： C26H42O9
Molecular formula furigana： C26-H42-O9
Molecular weight： 498.613
InChI： InChI=1S/C26H42O9/c1-15-7-11-26(24(33)35-23-22(32)21(31)20(30)18(14-29)34-23)16(2)5-4-6-19(26)25(15,3)10-8-17(13-28)9-12-27/h9,15,18-23,27-32H,2,4-8,10-14H2,1,3H3/b17-9-/t15-,18-,19-,20-,21+,22-,23+,25+,26-/m1/s1
InChI key： BUPXBDSZSIVFMU-VCRJQRCTSA-N
SMILES： C[C@@H]1CC[C@@]2([C@H](CCCC2=C)[C@@]1(C)CC/C(=C/CO)/CO)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (5S,8R,9S,10R,13Z)-15,16-ジヒドロキシクレロダ-4(19),13-ジエン-18-酸β-D-グルコピラノシル
  • (2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル (1S,2R,4aS,8aR)-1-[(3Z)-5-ヒドロキシ-3-(ヒドロキシメチル)ペンタ-3-エン-1-イル]-1,2-ジメチル-5-メチリデン-デカヒドロナフタレン-4a-カルボキシラート
  • (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (1S,2R,4aS,8aR)-1-[(3Z)-5-hydroxy-3-(hydroxymethyl)pent-3-en-1-yl]-1,2-dimethyl-5-methylidene-decahydronaphthalene-4a-carboxylate
Other name (3)：
  • (5S,8R,9S,10R,13Z)-15,16-Dihydroxycleroda-4(19),13-diene-18-oic acid β-D-glucopyranosyl ester
  • ポルウェニンB
  • Porwenin B
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM