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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H28N8O8
Molecular Weight 484.4637
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MILDIOMYCIN C

SMILES

[H][C@@]1(O[C@H](C=C[C@@H]1NC(=O)[C@@H](N)CO)N2C=CC(N)=NC2=O)[C@](O)(C[C@@H](O)CNC(N)=N)C(O)=O

InChI

InChIKey=HNOHJRMHJUPCHB-VDBCCMNASA-N
InChI=1S/C18H28N8O8/c19-9(7-27)14(29)24-10-1-2-12(26-4-3-11(20)25-17(26)32)34-13(10)18(33,15(30)31)5-8(28)6-23-16(21)22/h1-4,8-10,12-13,27-28,33H,5-7,19H2,(H,24,29)(H,30,31)(H2,20,25,32)(H4,21,22,23)/t8-,9+,10+,12-,13+,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H28N8O8
Molecular Weight 484.4637
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:59:12 GMT 2023
Edited
by admin
on Sat Dec 16 09:59:12 GMT 2023
Record UNII
AEG65AE76G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MILDIOMYCIN C
Common Name English
5-DEHYDROXYMETHYLMILDIOMYCIN
Common Name English
.ALPHA.-L-LYXO-HEPT-2-ENOPYRANURONIC ACID, 4-(((2S)-2-AMINO-3-HYDROXY-1-OXOPROPYL)AMINO)-6-C-((2R)-3-((AMINOIMINOMETHYL)AMINO)-2-HYDROXYPROPYL)-1-(4-AMINO-2-OXO-1(2H)-PYRIMIDINYL)-1,2,3,4-TETRADEOXY-
Systematic Name English
4-(((2S)-2-AMINO-3-HYDROXY-1-OXOPROPYL)AMINO)-6-C-((2R)-3-((AMINOIMINOMETHYL)AMINO)-2-HYDROXYPROPYL)-1-(4-AMINO-2-OXO-1(2H)-PYRIMIDINYL)-1,2,3,4-TETRADEOXY-.ALPHA.-L-LYXO-HEPT-2-ENOPYRANURONIC ACID
Systematic Name English
Code System Code Type Description
CAS
78162-87-5
Created by admin on Sat Dec 16 09:59:12 GMT 2023 , Edited by admin on Sat Dec 16 09:59:12 GMT 2023
PRIMARY
PUBCHEM
3060482
Created by admin on Sat Dec 16 09:59:12 GMT 2023 , Edited by admin on Sat Dec 16 09:59:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID60999406
Created by admin on Sat Dec 16 09:59:12 GMT 2023 , Edited by admin on Sat Dec 16 09:59:12 GMT 2023
PRIMARY
FDA UNII
AEG65AE76G
Created by admin on Sat Dec 16 09:59:12 GMT 2023 , Edited by admin on Sat Dec 16 09:59:12 GMT 2023
PRIMARY