Dataset

Ginsenoside-Rc

This MassBank record with Accession MSBNK-Fiocruz-FIO00107 contains the MS2 mass spectrum of Ginsenoside-Rc with the InChIkey JDCPEKQWFDWQLI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3
SMILES C(O1)(C(O)C(C(OC(C8O)OC(CO)C(C8O)O)C1OC(C2(C)C)CCC(C73)(C2CCC3(C)C(C)(C4C(O)C7)CCC4C(CCC=C(C)C)(C)OC(C6O)OC(C(O)C6O)COC(O5)C(O)C(O)C(CO)5)C)O)CO
InChI Key JDCPEKQWFDWQLI-UHFFFAOYSA-N
Molecular Formula C53H90O22
Exact Mass 1078.592 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00107
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:35:35.112184
MetadataModified 2024-01-11T16:35:35.292587
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables