| Properties | Image |
|---|
| MNX_ID | MNXM155596 |
 |
| reference | chebi:76376 |
| formula | C150H196N30O103P14 |
| global charge | 0 |
| mol weight | 4500.961 |
| InChIKey | ZDAMSCLJLJVJHR-MUWCNIOGSA-N |
| InChI | InChI=1S/C150H196N30O103P14/c1-61-31-166(136(198)151-121(61)183)106-16-76(182)92(256-106)47-241-284(213,214)271-78-18-108(168-33-63(3)123(185)153-138(168)200)258-94(78)49-243-286(217,218)273-80-20-110(170-35-65(5)125(187)155-140(170)202)260-96(80)51-245-288(221,222)275-82-22-112(172-37-67(7)127(189)157-142(172)204)262-98(82)53-247-290(225,226)277-84-24-114(174-39-69(9)129(191)159-144(174)206)264-100(84)55-249-292(229,230)279-86-26-116(176-41-71(11)131(193)161-146(176)208)266-102(86)57-251-294(233,234)281-88-28-118(178-43-73(13)133(195)163-148(178)210)268-104(88)59-253-296(237,238)283-90-30-120(180-45-75(15)135(197)165-150(180)212)269-105(90)60-254-297(239,240)282-89-29-119(179-44-74(14)134(196)164-149(179)211)267-103(89)58-252-295(235,236)280-87-27-117(177-42-72(12)132(194)162-147(177)209)265-101(87)56-250-293(231,232)278-85-25-115(175-40-70(10)130(192)160-145(175)207)263-99(85)54-248-291(227,228)276-83-23-113(173-38-68(8)128(190)158-143(173)205)261-97(83)52-246-289(223,224)274-81-21-111(171-36-66(6)126(188)156-141(171)203)259-95(81)50-244-287(219,220)272-79-19-109(169-34-64(4)124(186)154-139(169)201)257-93(79)48-242-285(215,216)270-77-17-107(255-91(77)46-181)167-32-62(2)122(184)152-137(167)199/h31-45,76-120,181-182H,16-30,46-60H2,1-15H3,(H,213,214)(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H,151,183,198)(H,152,184,199)(H,153,185,200)(H,154,186,201)(H,155,187,202)(H,156,188,203)(H,157,189,204)(H,158,190,205)(H,159,191,206)(H,160,192,207)(H,161,193,208)(H,162,194,209)(H,163,195,210)(H,164,196,211)(H,165,197,212)/t76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,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+/m0/s1 |
| SMILES | CC1=CN([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3OP(=O)(O)OC[C@H]3O[C@@H](N4C=C(C)C(=O)NC4=O)C[C@@H]3O)[C@@H](CO)O2)C(=O)NC1=O |
MNX internals
| InChI (mnx) | InChI=1/C150H196N30O103P14/c1-61-31-166(136(198)151-121(61)183)106-16-76(182)92(256-106)47-241-284(213,214)271-78-18-108(168-33-63(3)123(185)153-138(168)200)258-94(78)49-243-286(217,218)273-80-20-110(170-35-65(5)125(187)155-140(170)202)260-96(80)51-245-288(221,222)275-82-22-112(172-37-67(7)127(189)157-142(172)204)262-98(82)53-247-290(225,226)277-84-24-114(174-39-69(9)129(191)159-144(174)206)264-100(84)55-249-292(229,230)279-86-26-116(176-41-71(11)131(193)161-146(176)208)266-102(86)57-251-294(233,234)281-88-28-118(178-43-73(13)133(195)163-148(178)210)268-104(88)59-253-296(237,238)283-90-30-120(180-45-75(15)135(197)165-150(180)212)269-105(90)60-254-297(239,240)282-89-29-119(179-44-74(14)134(196)164-149(179)211)267-103(89)58-252-295(235,236)280-87-27-117(177-42-72(12)132(194)162-147(177)209)265-101(87)56-250-293(231,232)278-85-25-115(175-40-70(10)130(192)160-145(175)207)263-99(85)54-248-291(227,228)276-83-23-113(173-38-68(8)128(190)158-143(173)205)261-97(83)52-246-289(223,224)274-81-21-111(171-36-66(6)126(188)156-141(171)203)259-95(81)50-244-287(219,220)272-79-19-109(169-34-64(4)124(186)154-139(169)201)257-93(79)48-242-285(215,216)270-77-17-107(255-91(77)46-181)167-32-62(2)122(184)152-137(167)199/h31-45,76-120,181-182H,16-30,46-60H2,1-15H3,(H,213,214)(H,215,216)(H,217,218)(H,219,220)(H,221,222)(H,223,224)(H,225,226)(H,227,228)(H,229,230)(H,231,232)(H,233,234)(H,235,236)(H,237,238)(H,239,240)(H,151,183,198)(H,152,184,199)(H,153,185,200)(H,154,186,201)(H,155,187,202)(H,156,188,203)(H,157,189,204)(H,158,190,205)(H,159,191,206)(H,160,192,207)(H,161,193,208)(H,162,194,209)(H,163,195,210)(H,164,196,211)(H,165,197,212)/t76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,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+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:61]1=[CH:31][N:166]([C@H:106]2[CH2:16][C@H:76]([OH:182])[C@@H:92]([CH2:47][O:241][P:284]([OH:213])(=[O:214])[O:271][C@H:78]3[CH2:18][C@H:108]([N:168]4[CH:33]=[C:63]([CH3:3])[C:123]([OH:185])=[N:153][C:138]4=[O:200])[O:258][C@@H:94]3[CH2:49][O:243][P:286]([OH:217])(=[O:218])[O:273][C@H:80]3[CH2:20][C@H:110]([N:170]4[CH:35]=[C:65]([CH3:5])[C:125]([OH:187])=[N:155][C:140]4=[O:202])[O:260][C@@H:96]3[CH2:51][O:245][P:288]([OH:221])(=[O:222])[O:275][C@H:82]3[CH2:22][C@H:112]([N:172]4[CH:37]=[C:67]([CH3:7])[C:127]([OH:189])=[N:157][C:142]4=[O:204])[O:262][C@@H:98]3[CH2:53][O:247][P:290]([OH:225])(=[O:226])[O:277][C@H:84]3[CH2:24][C@H:114]([N:174]4[CH:39]=[C:69]([CH3:9])[C:129]([OH:191])=[N:159][C:144]4=[O:206])[O:264][C@@H:100]3[CH2:55][O:249][P:292]([OH:229])(=[O:230])[O:279][C@H:86]3[CH2:26][C@H:116]([N:176]4[CH:41]=[C:71]([CH3:11])[C:131]([OH:193])=[N:161][C:146]4=[O:208])[O:266][C@@H:102]3[CH2:57][O:251][P:294]([OH:233])(=[O:234])[O:281][C@H:88]3[CH2:28][C@H:118]([N:178]4[CH:43]=[C:73]([CH3:13])[C:133]([OH:195])=[N:163][C:148]4=[O:210])[O:268][C@@H:104]3[CH2:59][O:253][P:296]([OH:237])(=[O:238])[O:283][C@H:90]3[CH2:30][C@H:120]([N:180]4[CH:45]=[C:75]([CH3:15])[C:135]([OH:197])=[N:165][C:150]4=[O:212])[O:269][C@@H:105]3[CH2:60][O:254][P:297]([OH:239])(=[O:240])[O:282][C@H:89]3[CH2:29][C@H:119]([N:179]4[CH:44]=[C:74]([CH3:14])[C:134]([OH:196])=[N:164][C:149]4=[O:211])[O:267][C@@H:103]3[CH2:58][O:252][P:295]([OH:235])(=[O:236])[O:280][C@H:87]3[CH2:27][C@H:117]([N:177]4[CH:42]=[C:72]([CH3:12])[C:132]([OH:194])=[N:162][C:147]4=[O:209])[O:265][C@@H:101]3[CH2:56][O:250][P:293]([OH:231])(=[O:232])[O:278][C@H:85]3[CH2:25][C@H:115]([N:175]4[CH:40]=[C:70]([CH3:10])[C:130]([OH:192])=[N:160][C:145]4=[O:207])[O:263][C@@H:99]3[CH2:54][O:248][P:291]([OH:227])(=[O:228])[O:276][C@H:83]3[CH2:23][C@H:113]([N:173]4[CH:38]=[C:68]([CH3:8])[C:128]([OH:190])=[N:158][C:143]4=[O:205])[O:261][C@@H:97]3[CH2:52][O:246][P:289]([OH:223])(=[O:224])[O:274][C@H:81]3[CH2:21][C@H:111]([N:171]4[CH:36]=[C:66]([CH3:6])[C:126]([OH:188])=[N:156][C:141]4=[O:203])[O:259][C@@H:95]3[CH2:50][O:244][P:287]([OH:219])(=[O:220])[O:272][C@H:79]3[CH2:19][C@H:109]([N:169]4[CH:34]=[C:64]([CH3:4])[C:124]([OH:186])=[N:154][C:139]4=[O:201])[O:257][C@@H:93]3[CH2:48][O:242][P:285]([OH:215])(=[O:216])[O:270][C@H:77]3[CH2:17][C@H:107]([N:167]4[CH:32]=[C:62]([CH3:2])[C:122]([OH:184])=[N:152][C:137]4=[O:199])[O:255][C@@H:91]3[CH2:46][OH:181])[O:256]2)[C:136](=[O:198])[N:151]=[C:121]1[OH:183] |
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