Chem
J-GLOBAL ID:200907051059517400   Nikkaji number:J2.052.932F

Pseudolarolide I

プソイドラロリドI
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: C30H42O8
Molecular formula furigana: C30-H42-O8
Molecular weight: 530.658
InChI: InChI=1S/C30H42O8/c1-16-12-29(13-17(2)24(32)36-29)34-18-14-27(6)20-8-7-19-25(3,4)35-22(31)11-21-30(19,33)15-28(20,38-37-21)10-9-26(27,5)23(16)18/h11,16-20,23,33H,7-10,12-15H2,1-6H3/t16-,17-,18-,19+,20+,23+,26-,27+,28-,29+,30-/m1/s1
InChI key: LLHMOGIXUJQWAK-FHPSIFHHSA-N
SMILES: C[C@@H]1C[C@]2(C[C@@H](C)[C@H]3[C@@H](C[C@@]4(C)[C@@H]5CC[C@@H]6[C@]7(O)C[C@@]5(CC[C@]34C)OOC7=CC(=O)OC6(C)C)O2)OC1=O
Systematic name  (3):
  • (10S,7α,12β,15β,18α)-1α,10β-ジヒドロキシ-3β,23β-エピジオキシ-6β,8α,14α,19,19-ペンタメチル-21-オキソ-11,20-ジオキサペンタシクロ[16.5.0.03,15.06,14.07,12]トリコサン-22-エン-10-[(2R)-2-メチルプロパン酸]10,10-ラクトン
  • (1R,4R,4'R,5R,6R,8S,10R,12S,13S,16R,25R)-25-ヒドロキシ-4,4',6,12,17,17-ヘキサメチル-9,18,22,23-テトラオキサスピロ[ヘキサシクロ[14.7.2.01,13.04,12.05,10.021,25]ペンタコサン-8,2'-オキソラン]-20-エン-5',19-ジオン
  • (1R,4R,4'R,5R,6R,8S,10R,12S,13S,16R,25R)-25-hydroxy-4,4',6,12,17,17-hexamethyl-9,18,22,23-tetraoxaspiro[hexacyclo[14.7.2.01,13.04,12.05,10.021,25]pentacosane-8,2'-oxolan]-20-ene-5',19-dione
Other name (3):
  • (10S,7α,12β,15β,18α)-1α,10β-Dihydroxy-3β,23β-epidioxy-6β,8α,14α,19,19-pentamethyl-21-oxo-11,20-dioxapentacyclo[16.5.0.03,15.06,14.07,12]tricosane-22-ene-10-[(2R)-2-methylpropanoic acid]10,10-lactone
  • プソイドラロリドI
  • Pseudolarolide I
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