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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H46NO13.Na
Molecular Weight 687.707
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NATAMYCIN SODIUM

SMILES

[Na+].[H][C@@]12C[C@H](O)C[C@]3(O)C[C@H](O)[C@@H](C([O-])=O)[C@]([H])(C[C@@]([H])(O[C@@H]4O[C@H](C)[C@@H](O)[C@H](N)[C@@H]4O)\C=C\C=C\C=C\C=C\C[C@@H](C)OC(=O)\C=C\[C@@]1([H])O2)O3

InChI

InChIKey=CBRIFMNOKRNQEF-KTYYKLRQSA-M
InChI=1S/C33H47NO13.Na/c1-18-10-8-6-4-3-5-7-9-11-21(45-32-30(39)28(34)29(38)19(2)44-32)15-25-27(31(40)41)22(36)17-33(42,47-25)16-20(35)14-24-23(46-24)12-13-26(37)43-18;/h3-9,11-13,18-25,27-30,32,35-36,38-39,42H,10,14-17,34H2,1-2H3,(H,40,41);/q;+1/p-1/b4-3+,7-5+,8-6+,11-9+,13-12+;/t18-,19-,20+,21+,22+,23-,24-,25+,27-,28+,29-,30+,32+,33-;/m1./s1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C33H46NO13
Molecular Weight 664.7172
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 14 / 14
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:38:22 UTC 2023
Edited
by admin
on Sat Dec 16 11:38:22 UTC 2023
Record UNII
E97SA84U57
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NATAMYCIN SODIUM
Common Name English
SODIUM PIMARICIN
Common Name English
Code System Code Type Description
PUBCHEM
137331870
Created by admin on Sat Dec 16 11:38:22 UTC 2023 , Edited by admin on Sat Dec 16 11:38:22 UTC 2023
PRIMARY
CAS
31634-95-4
Created by admin on Sat Dec 16 11:38:22 UTC 2023 , Edited by admin on Sat Dec 16 11:38:22 UTC 2023
PRIMARY
FDA UNII
E97SA84U57
Created by admin on Sat Dec 16 11:38:22 UTC 2023 , Edited by admin on Sat Dec 16 11:38:22 UTC 2023
PRIMARY