Arthrofactin
AlkaPlorer ID: AK325516
Synonym: None
IUPAC Name: 2-[6,9-di(butan-2-yl)-3-(carboxymethyl)-37-heptyl-27-(1-hydroxyethyl)-12,18-bis(hydroxymethyl)-15,21,24,33-tetrakis(2-methylpropyl)-2,5,8,11,14,17,20,23,26,29,32,35-dodecaoxo-1-oxa-4,7,10,13,16,19,22,25,28,31,34-undecazacycloheptatriacont-30-yl]acetic acid
Structure
SMILES: CCCCCCCC1CC(O)=NC(CC(C)C)C(O)=NC(CC(=O)O)C(O)=NC(C(C)O)C(O)=NC(CC(C)C)C(O)=NC(CC(C)C)C(O)=NC(CO)C(O)=NC(CC(C)C)C(O)=NC(CO)C(O)=NC(C(C)CC)C(O)=NC(C(C)CC)C(O)=NC(CC(=O)O)C(=O)O1
InChI: InChI=1S/C64H111N11O20/c1-15-18-19-20-21-22-39-27-48(79)65-40(23-32(4)5)54(84)68-44(28-49(80)81)58(88)75-53(38(14)78)63(93)69-43(26-35(10)11)55(85)66-41(24-33(6)7)56(86)71-46(30-76)59(89)67-42(25-34(8)9)57(87)72-47(31-77)60(90)73-52(37(13)17-3)62(92)74-51(36(12)16-2)61(91)70-45(29-50(82)83)64(94)95-39/h32-47,51-53,76-78H,15-31H2,1-14H3,(H,65,79)(H,66,85)(H,67,89)(H,68,84)(H,69,93)(H,70,91)(H,71,86)(H,72,87)(H,73,90)(H,74,92)(H,75,88)(H,80,81)(H,82,83)
InChIKey: HXMCERBOSXQYRH-UHFFFAOYSA-N
Reference
A new lipopeptide biosurfactant produced by Arthrobacter sp. strain MIS38
PubChem CID: 17922875
LOTUS: LTS0253192
SuperNatural Ⅲ: SN0138164-03
COCONUT: CNP0116324.1
{NPAtlas: NPA000173
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Arthrobacter sp. | Arthrobacter | Micrococcaceae | Micrococcales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1354.6489999999997
TPSA？: 520.0800000000002
MolLogP？: 8.829900000000016
Number of H-Donors: 16
Number of H-Acceptors: 18
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|