Chem
J-GLOBAL ID：200907086308860088   Nikkaji number：J1.967.056B

Cordianol G

コルジアノールG
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(15-21(32)25-27(4,5)34-25)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-23(33)26(2,3)22(28)10-14-30(24,29)8/h15,18-22,24-25,31-32H,9-14,16H2,1-8H3/t18-,19-,20-,21+,22+,24-,25?,28+,29-,30-/m1/s1
InChI key： AYMSZJHDIUUULH-VYLHHDRZSA-N
SMILES： CC(=C[C@H](O)C1OC1(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
Systematic name  (3)：
  • (11R,23S)-11α,23-ジヒドロキシ-24,25-エポキシ-5α-ダンマラ-20(22)-エン-3-オン
  • (1S,3aR,3bR,5aR,9aS,9bR,10R,11aR)-1-[(4S)-4-(3,3-ジメチルオキシラン-2-イル)-4-ヒドロキシブタ-2-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-(3,3-dimethyloxiran-2-yl)-4-hydroxybut-2-en-2-yl]-10-hydroxy-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-one
Other name (3)：
  • (11R,23S)-11α,23-Dihydroxy-24,25-epoxy-5α-dammara-20(22)-ene-3-one
  • Cordianol G
  • コルジアノールG
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