PANTENICATE ,96922-80-4 _ChemCD

PANTENICATE

basic_info
Product_Name：	PANTENICATE
CAS：	96922-80-4
EnglishSynonyms：	PANTENICATE
pro_mdlNumber：	MFCD00865722
pro_acceptors：	28
pro_donors：	4
pro_smile：	CC(C)(COC(=O)CCC(=O)OCc1cccnc1)C(C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)C(C(C)(C)COC(=O)CCC(=O)OCc2cccnc2)OC(=O)CCC(=O)OCc3cccnc3)OC(=O)CCC(=O)OCc4cccnc4
InChi：	InChI=1S/C62H78N8O20S2/c1-61(2,41-87-53(77)15-13-49(73)83-37-43-9-5-23-63-33-43)57(89-55(79)19-17-51(75)85-39-45-11-7-25-65-35-45)59(81)69-27-21-47(71)67-29-31-91-92-32-30-68-48(72)22-28-70-60(82)58(90-56(80)20-18-52(76)86-40-46-12-8-26-66-36-46)62(3,4)42-88-54(78)16-14-50(74)84-38-44-10-6-24-64-34-44/h5-12,23-26,33-36,57-58H,13-22,27-32,37-42H2,1-4H3,(H,67,71)(H,68,72)(H,69,81)(H,70,82)
InChiKey：	InChIKey=PCGCUXHCEFYPOT-UHFFFAOYSA-N

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