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Ginsenoside Ia

PropertiesImageOccurences in reactions
MNX_IDMNXM126059Image of MNXM126059
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC42H72O14
charge0
mass800.49221
referencehmdb:HMDB0041471
InChIKeyAVTXSAWPGCSYFO-UHFFFAOYSA-N
InChIInChI=1S/C42H72O14/c1-20(2)10-9-13-42(8,56-37-34(52)32(50)30(48)25(19-44)54-37)21-11-15-40(6)28(21)22(45)16-26-39(5)14-12-27(38(3,4)35(39)23(46)17-41(26,40)7)55-36-33(51)31(49)29(47)24(18-43)53-36/h10,21-37,43-52H,9,11-19H2,1-8H3
SMILESCC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3C(O)CC12C
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0041471 Ginsenoside Ia
2-(Mercaptomethyl)heptane
2-Ethylhexane-1-thiol
2-Ethylhexanethiol
2-Ethylhexylmercaptan
2-{[2-(8,16-dihydroxy-2,6,6,10,11-pentamethyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl)-6-methylhept-5-en-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
FEMA 3833
hmdb:HMDB41471 secondary/obsolete/fantasy identifier