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PTILOSTEROID_B
SpectraBase Compound ID 3RAR76lW0TO
InChI InChI=1S/C21H34O7S.Na/c1-4-12-16(22)9-15-11-5-6-14-18(23)19(24)17(28-29(25,26)27)10-21(14,3)13(11)7-8-20(12,15)2;/h4,11-19,22-24H,1,5-10H2,2-3H3,(H,25,26,27);/q;+1/p-1/t11-,12+,13+,14+,15+,16+,17+,18-,19+,20-,21-;/m1./s1
InChIKey NRSCRCBQDPZRDP-QQCSVRBVSA-M
Mol Weight 452.5 g/mol
Molecular Formula C21H33NaO7S
Exact Mass 452.184469 g/mol
Parent InChIKey PALXRPIPFWOBFC-QCNKIUQCSA-M
Enantiomer InChIKey NRSCRCBQDPZRDP-XVHBEHNESA-M
Unknown Identification

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