CAS Number
Molecular Formula
C72H112O49S8
Product format
Neat
Molecular Weight
43435
API Family
Synonyms
Sugammadex Diastereomer 1 Sulfoxide; 2412953-11-6; FS183569
Iupac Name
3-[[(1S, 3S, 5S, 6S, 8S, 10S, 11S, 13S, 15S, 16S, 18S, 20S, 21S, 23S, 25S, 26S, 28S, 30S, 31S, 33S, 35S, 36S, 38S, 40S, 41R, 42R, 43R, 44R, 45R, 46R, 47R, 49R, 50R, 51R, 52R, 53R, 54R, 56R)-10, 15, 20, 30, 35, 40-hexakis(2-carboxyethylsulfanylmethyl)-25-(2-carboxyethylsulfinylmethyl)-41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56-hexadecahydroxy-2, 4, 7, 9, 12, 14, 17, 19, 22, 24, 27, 29, 32, 34, 37, 39-hexadecaoxanonacyclo[36.2.2.23, 6.28, 11.213, 16.218, 21.223, 26.228, 31.233 and 36]hexapentacontan-5-yl]methylsulfanyl]propanoic acid
InChI
InChI=1S/C72H112O49S8/c73-33(74)1-9-122-17-25-57-41(89)49(97)65(106-25)115-58-26(18-123-10-2-34(75)76)108-67(51(99)43(58)91)117-60-28(20-125-12-4-36(79)80)110-69(53(101)45(60)93)119-62-30(22-127-14-6-38(83)84)112-71(55(103)47(62)95)121-64-32(24-129(105)16-8-40(87)88)113-72(56(104)48(64)96)120-63-31(23-128-15-7-39(85)86)111-70(54(102)46(63)94)118-61-29(21-126-13-5-37(81)82)109-68(52(100)44(61)92)116-59-27(19-124-11-3-35(77)78)107-66(114-57)50(98)42(59)90/h25-32,41-72,89-104H,1-24H2,(H,73,74)(H,75,76)(H,77,78)(H,79,80)(H,81,82)(H,83,84)(H,85,86)(H,87,88)/t25-,26-,27-,28-,29-,30-,31-,32-,41?,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56?,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,129?/m1/s1
