| Properties | Image |
|---|
| MNX_ID | MNXM1371356 |
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| reference | biggM:o16a3und |
| formula | C157H255N3O82P2 |
| global charge | -2 |
| mol weight | 3558.654 |
| InChIKey | MAEXVFVVTLQJBE-UHFFFAOYSA-L |
| InChI | InChI=1S/C157H257N3O82P2/c1-66(2)32-22-33-67(3)34-23-35-68(4)36-24-37-69(5)38-25-39-70(6)40-26-41-71(7)42-27-43-72(8)44-28-45-73(9)46-29-47-74(10)48-30-49-75(11)50-31-51-76(12)52-53-214-243(204,205)242-244(206,207)241-145-100(160-82(18)169)134(112(187)97(226-145)65-210-148-122(197)115(190)106(181)91(59-166)223-148)235-157-142(220-85(21)172)137(103(178)79(15)217-157)238-152-125(200)118(193)109(184)94(229-152)62-213-154-139(128(203)131(232-154)88(175)56-163)240-144-99(159-81(17)168)133(111(186)96(225-144)64-209-147-121(196)114(189)105(180)90(58-165)222-147)234-156-141(219-84(20)171)136(102(177)78(14)216-156)237-151-124(199)117(192)108(183)93(228-151)61-212-153-138(127(202)130(231-153)87(174)55-162)239-143-98(158-80(16)167)132(110(185)95(224-143)63-208-146-120(195)113(188)104(179)89(57-164)221-146)233-155-140(218-83(19)170)135(101(176)77(13)215-155)236-150-123(198)116(191)107(182)92(227-150)60-211-149-126(201)119(194)129(230-149)86(173)54-161/h32,34,36,38,40,42,44,46,48,50,52,77-79,86-157,161-166,173-203H,22-31,33,35,37,39,41,43,45,47,49,51,53-65H2,1-21H3,(H,158,167)(H,159,168)(H,160,169)(H,204,205)(H,206,207)/p-2 |
| SMILES | CC(=O)NC1C(OC2C(OCC3OC(OC4C(O)C(C)OC(OC5C(O)C(COC6OC(CO)C(O)C(O)C6O)OC(OC6C(OCC7OC(OC8C(O)C(C)OC(OC9C(O)C(COC%10OC(CO)C(O)C(O)C%10O)OC(OP(=O)([O-])OP(=O)([O-])OCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C9NC(C)=O)C8OC(C)=O)C(O)C(O)C7O)OC(C(O)CO)C6O)C5NC(C)=O)C4OC(C)=O)C(O)C(O)C3O)OC(C(O)CO)C2O)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1OC1OC(C)C(O)C(OC2OC(COC3OC(C(O)CO)C(O)C3O)C(O)C(O)C2O)C1OC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C157H257N3O82P2/c1-66(2)32-22-33-67(3)34-23-35-68(4)36-24-37-69(5)38-25-39-70(6)40-26-41-71(7)42-27-43-72(8)44-28-45-73(9)46-29-47-74(10)48-30-49-75(11)50-31-51-76(12)52-53-214-243(204,205)242-244(206,207)241-145-100(160-82(18)169)134(112(187)97(226-145)65-210-148-122(197)115(190)106(181)91(59-166)223-148)235-157-142(220-85(21)172)137(103(178)79(15)217-157)238-152-125(200)118(193)109(184)94(229-152)62-213-154-139(128(203)131(232-154)88(175)56-163)240-144-99(159-81(17)168)133(111(186)96(225-144)64-209-147-121(196)114(189)105(180)90(58-165)222-147)234-156-141(219-84(20)171)136(102(177)78(14)216-156)237-151-124(199)117(192)108(183)93(228-151)61-212-153-138(127(202)130(231-153)87(174)55-162)239-143-98(158-80(16)167)132(110(185)95(224-143)63-208-146-120(195)113(188)104(179)89(57-164)221-146)233-155-140(218-83(19)170)135(101(176)77(13)215-155)236-150-123(198)116(191)107(182)92(227-150)60-211-149-126(201)119(194)129(230-149)86(173)54-161/h32,34,36,38,40,42,44,46,48,50,52,77-79,86-157,161-166,173-203H,22-31,33,35,37,39,41,43,45,47,49,51,53-65H2,1-21H3,(H,158,167)(H,159,168)(H,160,169)(H,204,205)(H,206,207)/b67-34?,68-36?,69-38?,70-40?,71-42?,72-44?,73-46?,74-48?,75-50?,76-52?/t77?,78?,79?,86?,87?,88?,89?,90?,91?,92?,93?,94?,95?,96?,97?,98?,99?,100?,101?,102?,103?,104?,105?,106?,107?,108?,109?,110?,111?,112?,113?,114?,115?,116?,117?,118?,119?,120?,121?,122?,123?,124?,125?,126?,127?,128?,129?,130?,131?,132?,133?,134?,135?,136?,137?,138?,139?,140?,141?,142?,143?,144?,145?,146?,147?,148?,149?,150?,151?,152?,153?,154?,155?,156?,157? |
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| SMILES (mnx) | [CH3:1][C:66]([CH3:2])=[CH:32][CH2:22][CH2:33][C:67]([CH3:3])=[CH:34][CH2:23][CH2:35][C:68]([CH3:4])=[CH:36][CH2:24][CH2:37][C:69]([CH3:5])=[CH:38][CH2:25][CH2:39][C:70]([CH3:6])=[CH:40][CH2:26][CH2:41][C:71]([CH3:7])=[CH:42][CH2:27][CH2:43][C:72]([CH3:8])=[CH:44][CH2:28][CH2:45][C:73]([CH3:9])=[CH:46][CH2:29][CH2:47][C:74]([CH3:10])=[CH:48][CH2:30][CH2:49][C:75]([CH3:11])=[CH:50][CH2:31][CH2:51][C:76]([CH3:12])=[CH:52][CH2:53][O:214][P:243]([OH:204])(=[O:205])[O:242][P:244]([OH:206])(=[O:207])[O:241][CH:145]1[CH:100]([N:160]=[C:82]([CH3:18])[OH:169])[CH:134]([O:235][CH:157]2[CH:142]([O:220][C:85]([CH3:21])=[O:172])[CH:137]([O:238][CH:152]3[CH:125]([OH:200])[CH:118]([OH:193])[CH:109]([OH:184])[CH:94]([CH2:62][O:213][CH:154]4[CH:139]([O:240][CH:144]5[CH:99]([N:159]=[C:81]([CH3:17])[OH:168])[CH:133]([O:234][CH:156]6[CH:141]([O:219][C:84]([CH3:20])=[O:171])[CH:136]([O:237][CH:151]7[CH:124]([OH:199])[CH:117]([OH:192])[CH:108]([OH:183])[CH:93]([CH2:61][O:212][CH:153]8[CH:138]([O:239][CH:143]9[CH:98]([N:158]=[C:80]([CH3:16])[OH:167])[CH:132]([O:233][CH:155]%10[CH:140]([O:218][C:83]([CH3:19])=[O:170])[CH:135]([O:236][CH:150]%11[CH:123]([OH:198])[CH:116]([OH:191])[CH:107]([OH:182])[CH:92]([CH2:60][O:211][CH:149]%12[CH:126]([OH:201])[CH:119]([OH:194])[CH:129]([CH:86]([CH2:54][OH:161])[OH:173])[O:230]%12)[O:227]%11)[CH:101]([OH:176])[CH:77]([CH3:13])[O:215]%10)[CH:110]([OH:185])[CH:95]([CH2:63][O:208][CH:146]%10[CH:120]([OH:195])[CH:113]([OH:188])[CH:104]([OH:179])[CH:89]([CH2:57][OH:164])[O:221]%10)[O:224]9)[CH:127]([OH:202])[CH:130]([CH:87]([CH2:55][OH:162])[OH:174])[O:231]8)[O:228]7)[CH:102]([OH:177])[CH:78]([CH3:14])[O:216]6)[CH:111]([OH:186])[CH:96]([CH2:64][O:209][CH:147]6[CH:121]([OH:196])[CH:114]([OH:189])[CH:105]([OH:180])[CH:90]([CH2:58][OH:165])[O:222]6)[O:225]5)[CH:128]([OH:203])[CH:131]([CH:88]([CH2:56][OH:163])[OH:175])[O:232]4)[O:229]3)[CH:103]([OH:178])[CH:79]([CH3:15])[O:217]2)[CH:112]([OH:187])[CH:97]([CH2:65][O:210][CH:148]2[CH:122]([OH:197])[CH:115]([OH:190])[CH:106]([OH:181])[CH:91]([CH2:59][OH:166])[O:223]2)[O:226]1 |
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