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醉茄内酯
Withanolide
南非醉茄提取物, (4β,5β,6β,22R)-4,20-Dihydroxy-5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione, WITHANOLIDE D(P), Ergosta-2,24-diene-1,26-dione, 5,6:22,26-diepoxy-4,20-dihydroxy-, (4β,5β,6β,22R)-, Withanolide D, Withanolide
CAS号: 30655-48-2
IUPAC名称: (1S,2R,6S,7R,9R,11S,12S,15S,16S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-6-hydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
分子式: C28H38O6
分子量: 470.598
InChI: InChI=1S/C28H38O6/c1-14-12-22(33-24(31)15(14)2)27(5,32)19-7-6-17-16-13-23-28(34-23)21(30)9-8-20(29)26(28,4)18(16)10-11-25(17,19)3/h8-9,16-19,21-23,30,32H,6-7,10-13H2,1-5H3/t16-,17-,18-,19-,21-,22+,23+,25-,26-,27+,28+/m0/s1
InChIKey: SASUFNRGCZMRFD-JCUIILOWSA-N
SMILES: CC1=C(C(=O)O[C@H](C1)[C@@](C)([C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@@H]6O)C)O5)C)O)C
EINECS: -
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