Chem
J-GLOBAL ID：200907002518782064   Nikkaji number：J1.691.716H

2-Cyano-3,12-dioxooleana-1,9(11)-diene-28-oic acid allyl ester

2-シアノ-3,12-ジオキソオレアナ-1,9(11)-ジエン-28-酸アリル
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： C34H45NO4
Molecular formula furigana： C34-H45-N-O4
Molecular weight： 531.737
InChI： InChI=1S/C34H45NO4/c1-9-16-39-28(38)34-14-12-29(2,3)19-22(34)26-23(36)17-25-31(6)18-21(20-35)27(37)30(4,5)24(31)10-11-32(25,7)33(26,8)13-15-34/h9,17-18,22,24,26H,1,10-16,19H2,2-8H3/t22-,24-,26-,31-,32+,33+,34-/m0/s1
InChI key： PTWUEXSNDZIQQV-FMIDTUQUSA-N
SMILES： CC1(C)CC[C@@]2(CC[C@]3(C)[C@@H]([C@@H]2C1)C(=O)C=C1[C@@]3(C)CC[C@H]2C(C)(C)C(=O)C(=C[C@]12C)C#N)C(=O)OCC=C
Systematic name  (3)：
  • 2-シアノ-3,12-ジオキソオレアナ-1,9(11)-ジエン-28-酸アリル
  • プロパ-2-エン-1-イル (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-シアノ-2,2,6a,6b,9,9,12a-ヘプタメチル-10,14-ジオキソ-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,12a,14,14a,14b-オクタデカヒドロピセン-4a-カルボキシラート
  • prop-2-en-1-yl (4aS,6aR,6bS,8aR,12aS,14aR,14bS)-11-cyano-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,12a,14,14a,14b-octadecahydropicene-4a-carboxylate
Other name (1)：
  • 2-Cyano-3,12-dioxooleana-1,9(11)-diene-28-oic acid allyl ester
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM