Chem
J-GLOBAL ID：200907014524711290   Nikkaji number：J1.741.559J

Elfvingic acid B

エルフビング酸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： C30H40O8
Molecular formula furigana： C30-H40-O8
Molecular weight： 528.642
InChI： InChI=1S/C30H40O8/c1-15(24(35)36)10-16(31)14-27(5,37)19-12-22(34)29(7)28(19,6)21(33)11-18-26(4)9-8-20(32)25(2,3)17(26)13-23-30(18,29)38-23/h11-12,15,17,22-23,34,37H,8-10,13-14H2,1-7H3,(H,35,36)/t15?,17-,22+,23-,26-,27-,28-,29+,30+/m0/s1
InChI key： DYPIHYCSZZORMA-HVTRFFBQSA-N
SMILES： CC(CC(=O)C[C@](C)(O)C1=C[C@@H](O)[C@@]2(C)[C@]34O[C@H]3C[C@H]3C(C)(C)C(=O)CC[C@]3(C)C4=CC(=O)[C@]12C)C(=O)O
Systematic name  (3)：
  • (20S)-7β,8β-エポキシ-15β,20-ジヒドロキシ-3,12,23-トリオキソラノスタ-9(11),16-ジエン-26-酸
  • (6S)-6-ヒドロキシ-6-[(1S,3S,5R,10S,14R,17R,18S)-17-ヒドロキシ-6,6,10,14,18-ペンタメチル-7,13-ジオキソ-2-オキサペンタシクロ[9.7.0.01,3.05,10.014,18]オクタデカ-11,15-ジエン-15-イル]-2-メチル-4-オキソヘプタン酸
  • (6S)-6-hydroxy-6-[(1S,3S,5R,10S,14R,17R,18S)-17-hydroxy-6,6,10,14,18-pentamethyl-7,13-dioxo-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadeca-11,15-dien-15-yl]-2-methyl-4-oxoheptanoic acid
Other name (3)：
  • (20S)-7β,8β-Epoxy-15β,20-dihydroxy-3,12,23-trioxolanosta-9(11),16-diene-26-oic acid
  • エルフビング酸B
  • Elfvingic acid B
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