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(20S)-ginsenoside F2

MNXM11674 is deprecated and here replaced by MNXM1371024
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371024 Image of MNXM1371024
referencechebi:77145
formulaC42H72O13
global charge0
mol weight785.025
InChIKeySWIROVJVGRGSPO-JBVRGBGGSA-N
InChIInChI=1S/C42H72O13/c1-21(2)10-9-14-42(8,55-37-35(51)33(49)31(47)25(20-44)53-37)22-11-16-41(7)29(22)23(45)18-27-39(5)15-13-28(38(3,4)26(39)12-17-40(27,41)6)54-36-34(50)32(48)30(46)24(19-43)52-36/h10,22-37,43-51H,9,11-20H2,1-8H3/t22-,23+,24+,25+,26-,27+,28-,29-,30+,31+,32-,33-,34+,35+,36-,37-,39-,40+,41+,42-/m0/s1
SMILESCC(C)=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(C)(C)[C@@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C42H72O13/c1-21(2)10-9-14-42(8,55-37-35(51)33(49)31(47)25(20-44)53-37)22-11-16-41(7)29(22)23(45)18-27-39(5)15-13-28(38(3,4)26(39)12-17-40(27,41)6)54-36-34(50)32(48)30(46)24(19-43)52-36/h10,22-37,43-51H,9,11-20H2,1-8H3/t22-,23+,24+,25+,26-,27+,28-,29-,30+,31+,32-,33-,34+,35+,36-,37-,39-,40+,41+,42-/m0/s1 Image of MNXM1371024
SMILES (mnx)[CH3:1][C:21]([CH3:2])=[CH:10][CH2:9][CH2:14][C@@:42]([CH3:8])([C@H:22]1[CH2:11][CH2:16][C@:41]2([CH3:7])[C@@H:29]1[C@H:23]([OH:45])[CH2:18][C@@H:27]1[C@@:39]3([CH3:5])[CH2:15][CH2:13][C@H:28]([O:54][C@H:36]4[C@H:34]([OH:50])[C@@H:32]([OH:48])[C@H:30]([OH:46])[C@@H:24]([CH2:19][OH:43])[O:52]4)[C:38]([CH3:3])([CH3:4])[C@@H:26]3[CH2:12][CH2:17][C@:40]12[CH3:6])[O:55][C@H:37]1[C@H:35]([OH:51])[C@@H:33]([OH:49])[C@H:31]([OH:47])[C@@H:25]([CH2:20][OH:44])[O:53]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77145
chebi:77145
SWIROVJVGRGSPO-JBVRGBGGSA-N 		(20S)-ginsenoside F2
(3beta,12beta)-20-(beta-D-glucopyranosyloxy)-12-hydroxydammar-24-en-3-yl beta-D-glucopyranoside
3beta,20-bis(beta-D-glucopyranosyloxy)dammar-24-en-12beta-ol
ginsenoside F2

seed.compound:cpd31343
seedM:cpd31343
kegg.compound:C20779
keggC:C20779
SWIROVJVGRGSPO-JBVRGBGGSA-N 		Ginsenoside F2

metacyc.compound:CPD-12100
metacycM:CPD-12100
SWIROVJVGRGSPO-JBVRGBGGSA-N 		ginsenoside F2
(3beta,12beta)-20-(beta-D-glucopyranosyloxy)-12-hydroxydammar-24-en-3-yl beta-D-glucopyranoside

keggC:M_C20779
seedM:M_cpd31343 		secondary/obsolete/fantasy identifier