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Details

Stereochemistry ABSOLUTE
Molecular Formula C48H72N11O8.Co
Molecular Weight 990.0874
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of COBINAMIDE

SMILES

[Co+3].[H][C@]12[N-]C(=C(C)C3=NC(=CC4=NC(=C(C)C5=N[C@]1(C)[C@@](C)(CC(N)=O)[C@@H]5CCC(N)=O)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)C(C)(C)[C@@H]3CCC(N)=O)[C@](C)(CCC(=O)NC[C@@H](C)O)[C@H]2CC(N)=O

InChI

InChIKey=FEESAGIUMZGLMF-JFYQDRLCSA-M
InChI=1S/C48H73N11O8.Co/c1-23(60)22-55-38(67)16-17-45(6)29(18-35(52)64)43-48(9)47(8,21-37(54)66)28(12-15-34(51)63)40(59-48)25(3)42-46(7,20-36(53)65)26(10-13-32(49)61)30(56-42)19-31-44(4,5)27(11-14-33(50)62)39(57-31)24(2)41(45)58-43;/h19,23,26-29,43,60H,10-18,20-22H2,1-9H3,(H14,49,50,51,52,53,54,55,56,57,58,59,61,62,63,64,65,66,67);/q;+3/p-1/t23-,26-,27-,28-,29+,43-,45-,46+,47+,48+;/m1./s1

HIDE SMILES / InChI

Molecular Formula Co
Molecular Weight 58.9332
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C48H72N11O8
Molecular Weight 931.1542
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:41:30 UTC 2023
Edited
by admin
on Sat Dec 16 08:41:30 UTC 2023
Record UNII
HP8A6YZX4S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COBINAMIDE
Common Name English
CORPHINAMIDE
Common Name English
(2,7,18-TRIS(2-AMINO-2-OXOETHYL)-N17-(2-HYDROXYPROPYL)-1,2,5,7,12,12,15,17-OCTAMETHYL-3,8,13,17-CORRINTETRAPROPANAMIDATO(1-)-N21,N22,N23,N24)COBALT(2+)
Systematic Name English
COBALT(3+);3-((1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-TRIS(2-AMINO-2-OXOETHYL)-3,13-BIS(3-AMINO-3-OXOPROPYL)-17-(3-(((2R)-2-HYDROXYPROPYL)AMINO)-3-OXOPROPYL)-1,2,5,7,12,12,15,17-OCTAMETHYL-8,13,18,19-TETRAHYDRO-3H-CORRIN-24-ID-8-YL)PROPANAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
11528127
Created by admin on Sat Dec 16 08:41:30 UTC 2023 , Edited by admin on Sat Dec 16 08:41:30 UTC 2023
PRIMARY
FDA UNII
HP8A6YZX4S
Created by admin on Sat Dec 16 08:41:30 UTC 2023 , Edited by admin on Sat Dec 16 08:41:30 UTC 2023
PRIMARY
CAS
13497-85-3
Created by admin on Sat Dec 16 08:41:30 UTC 2023 , Edited by admin on Sat Dec 16 08:41:30 UTC 2023
PRIMARY
CHEBI
28956
Created by admin on Sat Dec 16 08:41:30 UTC 2023 , Edited by admin on Sat Dec 16 08:41:30 UTC 2023
PRIMARY