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6-O-cis-methoxy-mycolyl-beta-D-mannopyranosyl-1-phosphoheptaprenol

PropertiesImageOccurences in reactions
MNX_IDMNXM10382Image of MNXM10382
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
formulaC126H234O12P
charge-1
mass1972.219
referenceseedM:cpd26562
InChIKeyPJQBWOHRXQEQKM-RRWWVROBSA-M
InChIInChI=1S/C126H235O12P/c1-13-15-17-19-21-23-25-27-29-31-32-33-34-35-36-40-47-53-59-65-71-77-101-118(125(131)135-107-121-122(128)123(129)124(130)126(137-121)138-139(132,133)136-105-104-114(10)97-85-96-113(9)95-84-94-112(8)93-83-92-111(7)91-82-90-110(6)89-81-88-109(5)87-80-86-108(3)4)119(127)102-78-72-66-60-54-48-41-37-39-45-51-57-63-69-75-99-116-106-117(116)100-76-70-64-58-52-46-42-43-49-55-61-67-73-79-103-120(134-12)115(11)98-74-68-62-56-50-44-38-30-28-26-24-22-20-18-16-14-2/h86,88,90,92,94,96,104,115-124,126-130H,13-85,87,89,91,93,95,97-103,105-107H2,1-12H3,(H,132,133)/p-1/b109-88+,110-90+,111-92+,112-94+,113-96+,114-104+/t115?,116?,117?,118?,119-,120?,121-,122-,123+,124+,126-/m1/s1
SMILES[CH3:1][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:40][CH2:47][CH2:53][CH2:59][CH2:65][CH2:71][CH2:77][CH2:101][CH:118]([C@@H:119]([CH2:102][CH2:78][CH2:72][CH2:66][CH2:60][CH2:54][CH2:48][CH2:41][CH2:37][CH2:39][CH2:45][CH2:51][CH2:57][CH2:63][CH2:69][CH2:75][CH2:99][CH:116]1[CH2:106][CH:117]1[CH2:100][CH2:76][CH2:70][CH2:64][CH2:58][CH2:52][CH2:46][CH2:42][CH2:43][CH2:49][CH2:55][CH2:61][CH2:67][CH2:73][CH2:79][CH2:103][CH:120]([CH:115]([CH3:11])[CH2:98][CH2:74][CH2:68][CH2:62][CH2:56][CH2:50][CH2:44][CH2:38][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH3:2])[O:134][CH3:12])[OH:127])[C:125](=[O:131])[O:135][CH2:107][C@@H:121]1[C@@H:122]([OH:128])[C@H:123]([OH:129])[C@H:124]([OH:130])[C@@H:126]([O:138][P:139]([OH:132])(=[O:133])[O:136][CH2:105]/[CH:104]=[C:114](\[CH3:10])[CH2:97][CH2:85]/[CH:96]=[C:113](\[CH3:9])[CH2:95][CH2:84]/[CH:94]=[C:112](\[CH3:8])[CH2:93][CH2:83]/[CH:92]=[C:111](\[CH3:7])[CH2:91][CH2:82]/[CH:90]=[C:110](\[CH3:6])[CH2:89][CH2:81]/[CH:88]=[C:109](\[CH3:5])[CH2:87][CH2:80][CH:86]=[C:108]([CH3:3])[CH3:4])[O:137]1
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Similar chemical compounds in external resources
IdentifierDescription
metacyc.compound:CPD1G-105
metacycM:CPD1G-105
seed.compound:cpd26562
seedM:cpd26562
6-O-cis-methoxy-mycolyl-beta-D-mannopyranosyl-1-phosphoheptaprenol
seedM:M_cpd26562 secondary/obsolete/fantasy identifier