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C34-phthiocerol A

PropertiesImage
MNX_IDMNXM167362 Image of MNXM167362
referencemetacycM:CPD-18633
formulaC34H70O3
global charge0
mol weight526.931
InChIKeyIVPFDOZWCWTFPQ-KRFMAMIKSA-N
InChIInChI=1S/C34H70O3/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-32(35)30-33(36)29-26-25-27-31(3)34(6-2)37-4/h31-36H,5-30H2,1-4H3/t31-,32+,33+,34+/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C[C@H](O)CCCC[C@H](C)[C@@H](CC)OC
MNX internals
InChI (mnx)InChI=1/C34H70O3/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-32(35)30-33(36)29-26-25-27-31(3)34(6-2)37-4/h31-36H,5-30H2,1-4H3/t31-,32+,33+,34+/m0/s1 Image of MNXM167362
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:28][C@H:32]([CH2:30][C@@H:33]([CH2:29][CH2:26][CH2:25][CH2:27][C@H:31]([CH3:3])[C@@H:34]([CH2:6][CH3:2])[O:37][CH3:4])[OH:36])[OH:35]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-18633
metacycM:CPD-18633
IVPFDOZWCWTFPQ-KRFMAMIKSA-N
C34-phthiocerol A
3-methoxy-4-methyldotriacontane-9,11-diol

seed.compound:cpd35937
seedM:cpd35937
IVPFDOZWCWTFPQ-KRFMAMIKSA-N
3-methoxy-4-methyldotriacontane-9,11-diol
C34-phthiocerol A

seedM:M_cpd35937
secondary/obsolete/fantasy identifier