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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

CN1CC(=O)N2[C@H]3NC4=C(C=CC=C4)[C@]3([C@@H](O)[C@]2(SS)C1=O)[C@]56[C@H](NC7=C5C=CC=C7)N8C(=O)[C@@]9(SS[C@@]8([C@H]6O)C(=O)N9C)C(C)=O

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 Mon Mar 31 22:36:01 GMT 2025
Edited
by admin
on Mon Mar 31 22:36:01 GMT 2025
Record UNII
6Q3K31AIZE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERTICILLIN G, (+)-
Preferred Name English
VERTICILLIN G
Common Name English
Code System Code Type Description
CAS
933785-95-6
Created by admin on Mon Mar 31 22:36:01 GMT 2025 , Edited by admin on Mon Mar 31 22:36:01 GMT 2025
PRIMARY
FDA UNII
6Q3K31AIZE
Created by admin on Mon Mar 31 22:36:01 GMT 2025 , Edited by admin on Mon Mar 31 22:36:01 GMT 2025
PRIMARY
PUBCHEM
72710750
Created by admin on Mon Mar 31 22:36:01 GMT 2025 , Edited by admin on Mon Mar 31 22:36:01 GMT 2025
PRIMARY