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(20S)-ginsenoside F1

MNXM13555 is deprecated and here replaced by MNXM728152
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM728152 Image of MNXM728152
referencechebi:77150
formulaC36H62O9
global charge0
mol weight638.883
InChIKeyXNGXWSFSJIQMNC-FIYORUNESA-N
InChIInChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,45-31-29(43)28(42)27(41)23(18-37)44-31)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(40)32(3,4)30(33)22(39)17-35(24,34)7/h10,20-31,37-43H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,30-,31-,33+,34+,35+,36-/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(C)(C)[C@@H]3[C@@H](O)C[C@]12C
MNX internals
InChI (mnx)InChI=1/C36H62O9/c1-19(2)10-9-13-36(8,45-31-29(43)28(42)27(41)23(18-37)44-31)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(40)32(3,4)30(33)22(39)17-35(24,34)7/h10,20-31,37-43H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24+,25-,26-,27+,28-,29+,30-,31-,33+,34+,35+,36-/m0/s1 Image of MNXM728152
SMILES (mnx)[CH3:1][C:19]([CH3:2])=[CH:10][CH2:9][CH2:13][C@@:36]([CH3:8])([C@H:20]1[CH2:11][CH2:15][C@:34]2([CH3:6])[C@@H:26]1[C@H:21]([OH:38])[CH2:16][C@@H:24]1[C@@:33]3([CH3:5])[CH2:14][CH2:12][C@H:25]([OH:40])[C:32]([CH3:3])([CH3:4])[C@@H:30]3[C@@H:22]([OH:39])[CH2:17][C@:35]12[CH3:7])[O:45][C@H:31]1[C@H:29]([OH:43])[C@@H:28]([OH:42])[C@H:27]([OH:41])[C@@H:23]([CH2:18][OH:37])[O:44]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77150
chebi:77150
XNGXWSFSJIQMNC-FIYORUNESA-N 		(20S)-ginsenoside F1
(beta,6alpha,12beta)-3,6,12-trihydroxydammar-24-en-20-yl beta-D-glucopyranoside
ginsenoside F1

kegg.compound:C20780
keggC:C20780
XNGXWSFSJIQMNC-FIYORUNESA-N 		Ginsenoside F1

seed.compound:cpd31344
seedM:cpd31344
XNGXWSFSJIQMNC-FIYORUNESA-N 		Ginsenoside F1
(3beta,6alpha,12beta)-trihydroxydammar-24-en-20-yl beta-D-glucopyranoside
ginsenoside F1

metacyc.compound:CPD-15448
metacycM:CPD-15448
XNGXWSFSJIQMNC-FIYORUNESA-N 		ginsenoside F1
(3beta,6alpha,12beta)-trihydroxydammar-24-en-20-yl beta-D-glucopyranoside

keggC:M_C20780
seedM:M_cpd31344 		secondary/obsolete/fantasy identifier