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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H28N6O7S4
Molecular Weight 712.839
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERTICILLIN G

SMILES

[H][C@]12NC3=CC=CC=C3[C@]1([C@@H](O)[C@@]4(SS)N2C(=O)CN(C)C4=O)[C@]56[C@H](O)[C@]78SS[C@@](N(C)C7=O)(C(C)=O)C(=O)N8[C@@]5([H])NC9=CC=CC=C69

InChI

InChIKey=CVDBEMJTPGTIID-NFIMPBGESA-N
InChI=1S/C30H28N6O7S4/c1-13(37)28-25(43)36-22-27(15-9-5-7-11-17(15)32-22,20(40)30(36,47-46-28)24(42)34(28)3)26-14-8-4-6-10-16(14)31-21(26)35-18(38)12-33(2)23(41)29(35,45-44)19(26)39/h4-11,19-22,31-32,39-40,44H,12H2,1-3H3/t19-,20+,21-,22-,26-,27-,28+,29+,30+/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H28N6O7S4
Molecular Weight 712.839
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:16:37 GMT 2023
Edited
by admin
on Sat Dec 16 09:16:37 GMT 2023
Record UNII
6Q3K31AIZE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERTICILLIN G
Common Name English
VERTICILLIN G, (+)-
Systematic Name English
Code System Code Type Description
CAS
933785-95-6
Created by admin on Sat Dec 16 09:16:37 GMT 2023 , Edited by admin on Sat Dec 16 09:16:37 GMT 2023
PRIMARY
FDA UNII
6Q3K31AIZE
Created by admin on Sat Dec 16 09:16:37 GMT 2023 , Edited by admin on Sat Dec 16 09:16:37 GMT 2023
PRIMARY
PUBCHEM
72710750
Created by admin on Sat Dec 16 09:16:37 GMT 2023 , Edited by admin on Sat Dec 16 09:16:37 GMT 2023
PRIMARY