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NotoginsenosideFa

CAT: 1410-M19219-03Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M19219-03Size:1 mL x 10 mM in DMSO
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Description
Notoginsenosides Fa and R4 show significant neurite outgrowth enhancing activities in human neuroblastoma SK-N-SH cells.
CAS Number
88100-04-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
1241.42
Molecular Formula
C59H100O27
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Notoginsenoside Fa

Notoginsenoside Fa has been reported in Panax japonicus and Panax notoginseng with data available.

CAS Number88100-04-3
PubChem CID75054973
IUPAC Name2-[[6-[2-[3-[3-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC59H100O27
Molecular Weight1241.4
XLogP-1.3
Topological Polar Surface Area436
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count27
Rotatable Bond Count18
Heavy Atom Count86
Formal Charge0
Complexity2270
SMILES
CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)OC7C(C(C(CO7)O)O)O)C)C)O)C)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C
InChI
InChI=1S/C59H100O27/c1-24(2)10-9-14-59(8,86-52-47(76)42(71)40(69)31(82-52)23-78-50-46(75)41(70)37(66)28(19-60)79-50)25-11-16-58(7)35(25)26(63)18-33-56(5)15-13-34(55(3,4)32(56)12-17-57(33,58)6)83-53-48(43(72)38(67)29(20-61)80-53)85-54-49(44(73)39(68)30(21-62)81-54)84-51-45(74)36(65)27(64)22-77-51/h10,25-54,60-76H,9,11-23H2,1-8H3
InChIKey
HERICYNRBVMDFO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Notoginsenoside Fa
CAS: 88100-04-3
CID: 75054973
Formula: C59H100O27
MW: 1241.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1241.4
XLogP3-1.3
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count27
Rotatable Bond Count18
Exact Mass1240.64519791
Monoisotopic Mass1240.64519791
Topological Polar Surface Area436 Ų
Heavy Atom Count86
Formal Charge0
Complexity2270
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count34
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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MBS5750342NotoginsenosideFa

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