None
AlkaPlorer ID: AK441135
Synonym: None
IUPAC Name: 5,15,32,65-tetrachloro-64-[4,5-dihydroxy-6-(1-hydroxydecylideneamino)-3-(hydroxymethyl)oxan-2-yl]oxy-2,18,21,26,31,35,38,44,49,54,56,59-dodecahydroxy-22-(methylamino)-47-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14,16,20,23(61),24,26,29(60),30,32,35,38,41(57),42,44,46(51),47,49,53,55,58,62,65-heptacosaene-52-carboxylic acid
Structure
SMILES: CCCCCCCCCC(O)=NC1OC(OC2=C3C=C4C=C2OC2=C(Cl)C=C(C=C2Cl)C(O)C2N=C(O)C(N=C(O)C4N=C(O)C4N=C(O)C(N=C(O)C(NC)C5=CC=C(O)C(=C5)OC5=CC(O)=C(Cl)C4=C5)C(O)C4=CC=C(O3)C(Cl)=C4)C3=CC=C(O)C(=C3)C3=C(OC4OC(CO)C(O)C(O)C4O)C=C(O)C=C3C(C(=O)O)N=C2O)C(CO)C(O)C1O
InChI: InChI=1S/C81H84Cl4N8O29/c1-3-4-5-6-7-8-9-10-53(100)87-78-68(106)65(103)40(28-94)80(122-78)121-71-50-22-33-23-51(71)118-70-42(83)19-34(20-43(70)84)64(102)62-77(113)91-60(79(114)115)38-24-35(96)25-49(119-81-69(107)67(105)66(104)52(29-95)120-81)54(38)37-17-30(11-14-44(37)97)57(73(109)93-62)88-74(110)58(33)89-75(111)59-39-26-36(27-46(99)55(39)85)116-48-21-31(12-15-45(48)98)56(86-2)72(108)92-61(76(112)90-59)63(101)32-13-16-47(117-50)41(82)18-32/h11-27,40,52,56-69,78,80-81,86,94-99,101-107H,3-10,28-29H2,1-2H3,(H,87,100)(H,88,110)(H,89,111)(H,90,112)(H,91,113)(H,92,108)(H,93,109)(H,114,115)
InChIKey: LBADJJYNXUZTCV-UHFFFAOYSA-N
Reference
Kibdelins (AAD-609), novel glycopeptide antibiotics. II Isolation, purification and structure.
PubChem CID: 163196136
CAS: 103528-50-3
LOTUS: LTS0069002
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kibdelosporangium aridum | Kibdelosporangium | Pseudonocardiaceae | Pseudonocardiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1775.4020000000007
TPSA？: 605.0600000000003
MolLogP？: 10.3412
Number of H-Donors: 22
Number of H-Acceptors: 29
RingCount: 15
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|