Chem
J-GLOBAL ID:200907018692009190   Nikkaji number:J1.967.057K

Cordianol H

コルジアノールH
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: C30H48O4
Molecular formula furigana: C30-H48-O4
Molecular weight: 472.710
InChI: InChI=1S/C30H48O4/c1-17(2)25(34)21(31)15-18(3)19-9-13-29(7)20(19)16-22(32)26-28(6)12-11-24(33)27(4,5)23(28)10-14-30(26,29)8/h15,19-23,26,31-32,34H,9-14,16H2,1-8H3/t19-,20-,21+,22-,23+,26-,28+,29-,30-/m1/s1
InChI key: LZYDZQQIXZPOKB-KRJMKRLLSA-N
SMILES: CC(=C(O)[C@@H](O)C=C(C)[C@H]1CC[C@]2(C)[C@@H]1C[C@@H](O)[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C)C
Systematic name  (3):
  • (11R,23S)-11α,23,24-トリヒドロキシ-5α-ダンマラ-20(22),24-ジエン-3-オン
  • (1S,3aR,3bR,5aR,9aS,9bR,10R,11aR)-1-[(4S)-4,5-ジヒドロキシ-6-メチルヘプタ-2,5-ジエン-2-イル]-10-ヒドロキシ-3a,3b,6,6,9a-ペンタメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7-オン
  • (1S,3aR,3bR,5aR,9aS,9bR,10R,11aR)-1-[(4S)-4,5-dihydroxy-6-methylhepta-2,5-dien-2-yl]-10-hydroxy-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-one
Other name (3):
  • (11R,23S)-11α,23,24-Trihydroxy-5α-dammara-20(22),24-diene-3-one
  • Cordianol H
  • コルジアノールH
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