Chem
J-GLOBAL ID：200907011095310747   Nikkaji number：J1.912.096A

Urs-12-ene-3β,11α-diol 3-palmitate

ウルサ-12-エン-3β,11α-ジオール3-パルミタート
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： C46H80O3
Molecular formula furigana： C46-H80-O3
Molecular weight： 681.143
InChI： InChI=1S/C46H80O3/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-39(48)49-38-26-28-44(7)37(42(38,4)5)25-29-46(9)41(44)36(47)32-35-40-34(3)33(2)24-27-43(40,6)30-31-45(35,46)8/h32-34,36-38,40-41,47H,10-31H2,1-9H3/t33-,34+,36-,37+,38+,40+,41-,43-,44+,45-,46-/m1/s1
InChI key： NUDDANFHEULIDY-WPIWJUEBSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2[C@H](O)C=C2[C@@H]4[C@@H](C)[C@H](C)CC[C@]4(C)CC[C@@]32C)C1(C)C
Systematic name  (3)：
  • ウルサ-12-エン-3β,11α-ジオール3-パルミタート
  • (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14R,14aR,14bS)-14-ヒドロキシ-4,4,6a,6b,8a,11,12,14b-オクタメチル-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-イコサヒドロピセン-3-イル ヘキサデカノアート
  • (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14R,14aR,14bS)-14-hydroxy-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl hexadecanoate
Other name (1)：
  • Urs-12-ene-3β,11α-diol 3-palmitate
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM