mycobacterial arabinogalactan containing α(1->3) and β(1->2) arabinofuran linkages
Chemical Formula:
C484H786NO358P2
Molecular Weight:
12409.272 Daltons
Monoisotopic Mass:
12405.3039820639 Daltons
SMILES:
CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(CCC=C(C)CCC=C(C)COP(=O)([O-])OP(=O)([O-])OC%80(OC(CO)C(OC%79(OC(C)C(OC%78(C(O)C(O)C(C(OC%77(C(O)C(O)C(C(O)COC%76(C(O)C(O)C(C(OC%75(C(O)C(O)C(C(OC%19(C(O)C(O)C(COC%18(C(O)C(O)C(COC%17(C(O)C(O)C(COC%16(C(O)C(O)C(COC%15(C(O)C(OC8(C(O)C(O)C(COC7(C(O)C(O)C(COC6(C(O)C(OC3(C(O)C(O)C(COC2(C(O)C(O)C(COC1(C(O)C(O)C(CO)O1))O2))O3))C(COC5(C(O)C(O)C(COC4(C(O)C(O)C(CO)O4))O5))O6))O7))O8))C(COC%14(C(O)C(O)C(COC%13(C(O)C(O)C(COC%12(C(O)C(O)C(COC%11(C(O)C(O)C(COC%10(C(O)C(O)C(COC9(C(O)C(O)C(CO)O9))O%10))O%11))O%12))O%13))O%14))O%15))O%16))O%17))O%18))O%19))COC%74(C(O)C(O)C(C(OC%73(C(O)C(O)C(C(OC%38(C(O)C(O)C(COC%37(C(O)C(O)C(COC%36(C(O)C(O)C(COC%35(C(O)C(O)C(COC%34(C(O)C(OC%27(C(O)C(O)C(COC%26(C(O)C(O)C(COC%25(C(O)C(OC%22(C(O)C(O)C(COC%21(C(O)C(O)C(COC%20(C(O)C(O)C(CO)O%20))O%21))O%22))C(COC%24(C(O)C(O)C(COC%23(C(O)C(O)C(CO)O%23))O%24))O%25))O%26))O%27))C(COC%33(C(O)C(O)C(COC%32(C(O)C(O)C(COC%31(C(O)C(O)C(COC%30(C(O)C(O)C(COC%29(C(O)C(O)C(COC%28(C(O)C(O)C(CO)O%28))O%29))O%30))O%31))O%32))O%33))O%34))O%35))O%36))O%37))O%38))COC%72(C(O)C(O)C(C(OC%71(C(O)C(O)C(C(OC%48(C(O)C(O)C(COC%47(C(O)C(O)C(COC%46(C(O)C(O)C(COC%45(C(O)C(O)C(COC%44(C(O)C(O)C(COC%43(C(O)C(O)C(COC%42(C(O)C(O)C(COC%41(C(O)C(O)C(COC%40(C(O)C(O)C(COC%39(C(O)C(O)C(CO)O%39))O%40))O%41))O%42))O%43))O%44))O%45))O%46))O%47))O%48))COC%70(C(O)C(O)C(C(OC%69(C(O)C(O)C(C(O)COC%68(C(O)C(O)C(C(OC%67(=C([O-])C(O)C(C(O)COC%66(C(O)C(O)C(C(OC%65(C(O)C(O)C(C(O)COC%64(C(O)C(O)C(C(OC%63(C(O)C(O)C(C(O)COC%62(C(O)C(O)C(C(OC%61(C(O)C(O)C(C(O)COC%60(C(O)C(O)C(C(OC%59(C(O)C(O)C(C(O)COC%58(C(O)C(O)C(C(OC%57(C(O)C(O)C(C(O)COC%56(C(O)C(O)C(C(OC%55(C(O)C(O)C(C(O)COC%54(C(O)C(O)C(C(OC%53(C(O)C(O)C(C(O)COC%52(C(O)C(O)C(C(OC%51(C(O)C(O)C(C(O)COC%50(C(O)C(O)C(C(OC%49(C(O)C(O)C(C(O)CO)O%49))CO)O%50))O%51))CO)O%52))O%53))CO)O%54))O%55))CO)O%56))O%57))CO)O%58))O%59))CO)O%60))O%61))CO)O%62))O%63))CO)O%64))O%65))CO)O%66))O%67))CO)O%68))O%69))CO)O%70))O%71))CO)O%72))O%73))CO)O%74))O%75))CO)O%76))O%77))CO)O%78))C(O)C(O)%79))C(O)C(NC(C)=O)%80))C
InChI:
1S/C484H789NO358P2/c1-14-122(2)24-15-25-123(3)26-16-27-124(4)28-17-29-125(5)30-18-31-126(6)32-19-33-127(7)34-20-35-128(8)36-21-37-129(9)38-22-39-130(10)40-23-41-131(11)66-737-844(678,679)843-845(680,681)842-405-213(485-133(13)510)258(567)382(153(50-494)746-405)833-461-348(657)259(568)369(132(12)738-461)806-484-364(673)286(595)397(834-484)168(65-509)758-480-360(669)271(580)381(818-480)145(522)77-692-453-344(653)282(591)393(829-453)165(62-506)759-481-361(670)287(596)398(835-481)207(804-463-328(637)252(561)200(793-463)109-720-433-317(626)241(550)191(782-433)100-713-426-310(619)238(547)188(777-426)97-715-430-319(628)247(556)195(784-430)104-726-457-365(674)403(211(801-457)120-732-441-325(634)245(554)193(790-441)102-717-428-312(621)236(545)186(779-428)95-710-423-307(616)233(542)180(774-423)89-704-417-301(610)227(536)177(768-417)86-701-414-298(607)222(531)170(763-414)79-694-407-291(600)215(524)147(44-488)740-407)840-467-332(641)256(565)204(797-467)113-724-437-321(630)249(558)197(786-437)106-728-459-367(676)401(209(799-459)118-730-439-323(632)243(552)174(788-439)83-698-411-295(604)219(528)151(48-492)744-411)838-465-330(639)254(563)202(795-465)111-722-435-314(623)224(533)172(765-435)81-696-409-293(602)217(526)149(46-490)742-409)116-735-455-346(655)284(593)395(831-455)167(64-508)761-483-363(672)289(598)400(837-483)208(805-464-329(638)253(562)201(794-464)110-721-434-318(627)242(551)192(783-434)101-714-427-311(620)239(548)189(778-427)98-716-431-320(629)248(557)196(785-431)105-727-458-366(675)404(212(802-458)121-733-442-326(635)246(555)194(791-442)103-718-429-313(622)237(546)187(780-429)96-711-424-308(617)234(543)181(775-424)90-705-418-302(611)228(537)178(769-418)87-702-415-299(608)223(532)171(764-415)80-695-408-292(601)216(525)148(45-489)741-408)841-468-333(642)257(566)205(798-468)114-725-438-322(631)250(559)198(787-438)107-729-460-368(677)402(210(800-460)119-731-440-324(633)244(553)175(789-440)84-699-412-296(605)220(529)152(49-493)745-412)839-466-331(640)255(564)203(796-466)112-723-436-315(624)225(534)173(766-436)82-697-410-294(603)218(527)150(47-491)743-410)117-736-456-347(656)285(594)396(832-456)166(63-507)760-482-362(671)288(597)399(836-482)206(803-462-327(636)251(560)199(792-462)108-719-432-316(625)240(549)190(781-432)99-712-425-309(618)235(544)185(776-425)94-709-422-306(615)232(541)184(773-422)93-708-421-305(614)231(540)183(772-421)92-707-420-304(613)230(539)182(771-420)91-706-419-303(612)229(538)179(770-419)88-703-416-300(609)226(535)176(767-416)85-700-413-297(606)221(530)169(762-413)78-693-406-290(599)214(523)146(43-487)739-406)115-734-454-345(654)283(592)394(830-454)164(61-505)757-479-359(668)270(579)380(817-479)144(521)76-691-452-343(652)281(590)392(828-452)163(60-504)756-478-358(667)269(578)379(816-478)143(520)75-690-451-342(651)280(589)391(827-451)162(59-503)755-477-357(666)268(577)378(815-477)142(519)74-689-450-341(650)279(588)390(826-450)161(58-502)754-476-356(665)267(576)377(814-476)141(518)73-688-449-340(649)278(587)389(825-449)160(57-501)753-475-355(664)266(575)376(813-475)140(517)72-687-448-339(648)277(586)388(824-448)159(56-500)752-474-354(663)265(574)375(812-474)139(516)71-686-447-338(647)276(585)387(823-447)158(55-499)751-473-353(662)264(573)374(811-473)138(515)70-685-446-337(646)275(584)386(822-446)157(54-498)750-472-352(661)263(572)373(810-472)137(514)69-684-445-336(645)274(583)385(821-445)156(53-497)749-471-351(660)262(571)372(809-471)136(513)68-683-444-335(644)273(582)384(820-444)155(52-496)748-470-350(659)261(570)371(808-470)135(512)67-682-443-334(643)272(581)383(819-443)154(51-495)747-469-349(658)260(569)370(807-469)134(511)42-486/h14,25,27,29,31,33,35,37,39,41,132,134-357,359-477,479-484,486-509,511-677H,15-24,26,28,30,32,34,36,38,40,42-121H2,1-13H3,(H,485,510)(H,678,679)(H,680,681)/p-3/b122-14-,123-25-,124-27-,125-29-,126-31-,127-33-,128-35-,129-37-,130-39+,131-41+/t132-,134+,135+,136+,137+,138+,139+,140+,141+,142+,143+,144+,145+,146+,147+,148+,149+,150+,151+,152+,153+,154+,155+,156+,157+,158+,159+,160+,161+,162+,163+,164+,165+,166+,167+,168+,169+,170+,171+,172+,173+,174+,175+,176+,177+,178+,179+,180+,181+,182+,183+,184+,185+,186+,187+,188+,189+,190+,191+,192+,193+,194+,195+,196+,197+,198+,199+,200+,201+,202+,203+,204+,205+,206+,207+,208+,209+,210+,211+,212+,213+,214+,215+,216+,217+,218+,219+,220+,221+,222+,223+,224+,225+,226+,227+,228+,229+,230+,231+,232+,233+,234+,235+,236+,237+,238+,239+,240+,241+,242+,243+,244+,245+,246+,247+,248+,249+,250+,251+,252+,253+,254+,255+,256+,257+,258+,259-,260+,261+,262+,263+,264+,265+,266+,267+,268+,269+,270+,271+,272+,273+,274+,275+,276+,277+,278+,279+,280+,281+,282+,283+,284+,285+,286+,287+,288+,289+,290-,291-,292-,293-,294-,295-,296-,297-,298-,299-,300-,301-,302-,303-,304-,305-,306-,307-,308-,309-,310-,311-,312-,313-,314-,315-,316-,317-,318-,319-,320-,321-,322-,323-,324-,325-,326-,327-,328-,329-,330-,331-,332-,333-,334+,335+,336+,337+,338+,339+,340+,341+,342+,343+,344+,345+,346+,347+,348+,349+,350+,351+,352+,353+,354+,355+,356+,357+,359+,360+,361+,362+,3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InChIKey:
Synonyms
- (Araf)70(Galf)30-Rha-GlcNAc-P-P-C50
Databases
MetaCyc:
CPD-12061
MetaNetX:
MNXM19485