OTAVA-FLUOR OTVD_0307

CAS No.
CCD No.
CCD00911742
Formula
C28 H27 N2 O4 S2 . C7 H7 O3 S
MolWeight
690.859

Basic Information

Product Name: OTAVA-FLUOR OTVD_0307
English Synonyms: OTAVA-FLUOR OTVD_0307
MDL Number.: MFCD10001262
H bond acceptor: 6
H bond donor: 0
Smile: CC[n+]1c2cc3c(cc2sc1/C=C/4\CCCC(=C4)/C=C\5/N(c6cc7c(cc6S5)OCO7)CC)OCO3.Cc1ccc(cc1)S(=O)(=O)[O-]
InChi: InChI=1S/C28H27N2O4S2.C7H8O3S/c1-3-29-19-11-21-23(33-15-31-21)13-25(19)35-27(29)9-17-6-5-7-18(8-17)10-28-30(4-2)20-12-22-24(34-16-32-22)14-26(20)36-28;1-6-2-4-7(5-3-6)11(8,9)10/h8-14H,3-7,15-16H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChiKey: InChIKey=MQAGZMZOSRHRKG-UHFFFAOYSA-M

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