PRD_000812

desulfo-A47934

PRD_000812 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 4EEC.

Find entries where PRD_000812 is present

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	desulfo-A47934
Identifiers	n/a
Formula	C₅₈ H₄₄ Cl₃ N₇ O₁₈
Molecular Weight	1,233.365
Type	PEPTIDE-LIKE
Isomeric SMILES	c1cc2c(cc1C[C@@H]3C(=O)N[C@@H](c4cc(cc(c4)Oc5cc(ccc5O)[C@H](C(=O)N3)N)O)C(=O)N[C@@H]6c7cc(c(c(c7)Oc8ccc(cc8Cl)[C@H]([C@H]9C(=O)N[C@@H](c1cc(cc(c1-c1cc(cc(c1O)Cl)[C@H](C(=O)N9)NC6=O)O)O)C(=O)O)O)O)O2)Cl
InChI	InChI=1S/C58H44Cl3N7O18/c59-31-7-20-1-5-37(31)85-40-15-25-16-41(51(40)75)86-38-6-3-22(12-32(38)60)49(73)48-57(81)67-47(58(82)83)29-18-27(70)19-36(72)42(29)30-11-24(13-33(61)50(30)74)45(56(80)68-48)65-55(79)46(25)66-54(78)44-23-9-26(69)17-28(10-23)84-39-14-21(2-4-35(39)71)43(62)53(77)63-34(8-20)52(76)64-44/h1-7,9-19,34,43-49,69-75H,8,62H2,(H,63,77)(H,64,76)(H,65,79)(H,66,78)(H,67,81)(H,68,80)(H,82,83)/t34-,43+,44+,45+,46-,47+,48+,49+/m1/s1
InChIKey	KJTFTWQSEBLIPM-DNSOEHMASA-N
Composition	Polymer Sequences: GHP-3MY-3FG-GHP-0UZ-OMY-3FG
BIRD class	ANTIBIOTIC
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	130
Chiral Atom Count	8
Bond Count	140
Aromatic Bond Count	42

Related Resource References

Resource Name	Reference
PubChem	57339436

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.