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Details

Stereochemistry ABSOLUTE
Molecular Formula C57H94O28
Molecular Weight 1227.3395
Optical Activity UNSPECIFIED
Defined Stereocenters 36 / 36
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PARVIFLOSIDE

SMILES

[H][C@]12C[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)[C@@](O)(CC[C@@H](C)CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O2)O[C@@]7([H])O[C@H](CO)[C@@H](O[C@]8([H])O[C@H](CO)[C@@H](O)[C@H](O[C@]9([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H]8O)[C@H](O)[C@H]7O[C@]%10([H])O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%10O

InChI

InChIKey=GJVYYBVWPSQRTC-MEIWCCOHSA-N
InChI=1S/C57H94O28/c1-21(20-75-50-42(69)40(67)36(63)30(16-58)78-50)8-13-57(74)22(2)34-29(85-57)15-28-26-7-6-24-14-25(9-11-55(24,4)27(26)10-12-56(28,34)5)77-54-49(84-51-43(70)39(66)35(62)23(3)76-51)45(72)47(33(19-61)81-54)82-53-46(73)48(38(65)32(18-60)80-53)83-52-44(71)41(68)37(64)31(17-59)79-52/h6,21-23,25-54,58-74H,7-20H2,1-5H3/t21-,22+,23+,25+,26-,27+,28+,29+,30-,31-,32-,33-,34+,35+,36-,37-,38-,39-,40+,41+,42-,43-,44-,45+,46-,47-,48+,49-,50-,51+,52+,53+,54+,55+,56+,57-/m1/s1

HIDE SMILES / InChI

Molecular Formula C57H94O28
Molecular Weight 1227.3395
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 35 / 36
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:03:39 GMT 2023
Edited
by admin
on Sat Dec 16 14:03:39 GMT 2023
Record UNII
NCM4V97CO0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PARVIFLOSIDE
Common Name English
(3.BETA.,25R)-26-(.BETA.-D-GLUCOPYRANOSYLOXY)-22-HYDROXYFUROST-5-EN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->3)-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->2))-.BETA.-D-GLUCOPYRANOSIDE
Systematic Name English
.BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,25R)-26-(.BETA.-D-GLUCOPYRANOSYLOXY)-22-HYDROXYFUROST-5-EN-3-YL O-.BETA.-D-GLUCOPYRANOSYL-(1->3)-O-.BETA.-D-GLUCOPYRANOSYL-(1->4)-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL-(1->2))-
Systematic Name English
Code System Code Type Description
FDA UNII
NCM4V97CO0
Created by admin on Sat Dec 16 14:03:39 GMT 2023 , Edited by admin on Sat Dec 16 14:03:39 GMT 2023
PRIMARY
PUBCHEM
134687323
Created by admin on Sat Dec 16 14:03:39 GMT 2023 , Edited by admin on Sat Dec 16 14:03:39 GMT 2023
PRIMARY
CAS
855779-32-7
Created by admin on Sat Dec 16 14:03:39 GMT 2023 , Edited by admin on Sat Dec 16 14:03:39 GMT 2023
PRIMARY