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[11]Cytochalas-13-ene-1,21-dione, 17,18-dihydroxy-14-methyl-10-(1-methylethyl)-, (6S,13E,17S,18S)-
SpectraBase Compound ID LevITov30bT
InChI InChI=1S/C24H39NO4/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)24(17,22)23(29)25-18/h11,13,15-20,22,26-27H,6-10,12H2,1-5H3,(H,25,29)/b14-11+/t15?,16-,17+,18+,19?,20?,22+,24-/m1/s1
InChIKey FDALSTKYPHDOHA-HWCNXIFPSA-N
Mol Weight 405.6 g/mol
Molecular Formula C24H39NO4
Exact Mass 405.287909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20rHn5SwHBs
Name [11]Cytochalas-13-ene-1,21-dione, 17,18-dihydroxy-14-methyl-10-(1-methylethyl)-, (6S,13E,17S,18S)-
Alternate Name(s) (3S,3aR,4R,6aR,15aS)-11,12-dihydroxy-3-isobutyl-4,5,8-trimethyl-3,3a,4,5,6,6a,9,10,11,12,13,14-dodecahydro-1H-cycloundeca[d]isoindole-1,15(2H)-dione 17,18-Dihydroxy-10-isopropyl-14-methyl(11)cytochalasa-13-en-1,21-dione (isomer b) 1H-cycloundec[d]isoindole, [11]cytochalas-13-ene-1,21-dione deriv. 6,7,19,20-Tetrahydro-6-epi-aspochalasin D 6,7,19,20-Tetrahydroaspochalasin D 6-epi-17,18-dihydroxy-10-isopropyl-14-methyl(11)cytochalasa-13-en-1,21,dione (isomerb)
CAS Registry Number 72363-28-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H39NO4
InChI InChI=1S/C24H39NO4/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)24(17,22)23(29)25-18/h11,13,15-20,22,26-27H,6-10,12H2,1-5H3,(H,25,29)/b14-11+/t15?,16-,17+,18+,19?,20?,22+,24-/m1/s1
InChIKey FDALSTKYPHDOHA-HWCNXIFPSA-N
Molecular Weight 405.579 g/mol
SMILES N1[C@]([C@]2([C@@]3(C(CCC(C(CC\C(=C\[C@]3(CC([C@]2(C)[H])C)[H])C)O)O)=O)C1=O)[H])(CC(C)C)[H]
SPLASH splash10-05fr-9087300000-9534e6b07917102cef2b
Source of Spectrum H-62-1518-0
Wiley ID 1371802