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Ginsenoside compound K

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304430

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR304430 contains the MS2 mass spectrum of Ginsenoside compound K with the InChIkey FVIZARNDLVOMSU-IRFFNABBSA-N.

Source: Ginsenoside compound K

Chemical Info

molecular Image

InChI	InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1
SMILES	CC(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]3CC[C@@]21C
InChI Key	FVIZARNDLVOMSU-IRFFNABBSA-N
Molecular Formula	C36H62O8
Exact Mass	622.884 g/mol

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Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	98079033-ba5a-453c-9983-55fe2349896d
Package id	msbnk-riken-pr304430
Resource type	HTML
State	active