CHEBI:71979 - surfactin D

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ChEBI Name surfactin D
Definition A cyclodepsipeptide that is N-[(3R)-3-hydroxy-14-methylpentadecanoyl]-L-α-glutamyl-L-leucyl-D-leucyl-L-valyl-L-α-aspartyl-D-leucyl-L-leucine in which the C-terminal carboxy group has been lactonised by condensation with the alcoholic hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C54H95N7O13
Net Charge 0
Average Mass 1050.37120
Monoisotopic Mass 1049.699
InChI InChI=1S/C54H95N7O13/c1-31(2)21-19-17-15-13-14-16-18-20-22-37-29-44(62)55-38(23-24-45(63)64)48(67)56-39(25-32(3)4)49(68)58-41(27-34(7)8)52(71)61-47(36(11)12)53(72)59-42(30-46(65)66)51(70)57-40(26-33(5)6)50(69)60-43(28-35(9)10)54(73)74-37/h31-43,47H,13-30H2,1-12H3,(H,55,62)(H,56,67)(H,57,70)(H,58,68)(H,59,72)(H,60,69)(H,61,71)(H,63,64)(H,65,66)/t37-,38+,39+,40-,41-,42+,43+,47+/m1/s1
SMILES [H][C@@]1(CCCCCCCCCCC(C)C)CC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O1
Roles Classification
Chemical Role(s): surfactant
A substance which lowers the surface tension of the medium in which it is dissolved, and/or the interfacial tension with other phases, and, accordingly, is positively adsorbed at the liquid/vapour and/or at other interfaces.
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): antibacterial agent
A substance that kills or slows the growth of bacteria.
antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
antiviral agent
A substance that destroys or inhibits replication of viruses.
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via peptide antibiotic )
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing surfactin D (CHEBI:71979) has role antibacterial agent (CHEBI:33282)
surfactin D (CHEBI:71979) has role antifungal agent (CHEBI:35718)
surfactin D (CHEBI:71979) has role antineoplastic agent (CHEBI:35610)
surfactin D (CHEBI:71979) has role antiviral agent (CHEBI:22587)
surfactin D (CHEBI:71979) has role metabolite (CHEBI:25212)
surfactin D (CHEBI:71979) has role surfactant (CHEBI:35195)
surfactin D (CHEBI:71979) is a cyclodepsipeptide (CHEBI:35213)
surfactin D (CHEBI:71979) is a lipopeptide antibiotic (CHEBI:25061)
surfactin D (CHEBI:71979) is a macrocyclic lactone (CHEBI:63944)
Incoming surfactin (CHEBI:29681) has part surfactin D (CHEBI:71979)
3-[(3S,6R,9S,12S,15R,18S,21S,25R)-9-(carboxymethyl)-3,6,15,18-tetraisobutyl-12-isopropyl-25-(11-methyldodecyl)-2,5,8,11,14,17,20,23-octaoxo-1-oxa-4,7,10,13,16,19,22-heptaazacyclopentacosan-21-yl]propanoic acid
Last Modified
31 January 2013