CHEBI:62522 - 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate
ChEBI ID CHEBI:62522
ChEBI ASCII Name 2-O-alpha-L-rhamnosyl-alpha-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate
Definition The monocarboxylic acid anion formed by loss of a proton from the carboxy group of 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoic acid; principal microspecies at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C32H57O13
Net Charge -1
Average Mass 649.78720
Monoisotopic Mass 649.38047
InChI InChI=1S/C32H58O13/c1-5-7-9-11-13-15-21(17-23(33)34)43-24(35)18-22(16-14-12-10-8-6-2)44-32-30(28(39)26(37)20(4)42-32)45-31-29(40)27(38)25(36)19(3)41-31/h19-22,25-32,36-40H,5-18H2,1-4H3,(H,33,34)/p-1/t19-,20-,21?,22?,25-,26-,27+,28+,29+,30+,31-,32-/m0/s1
InChIKey FCBUKWWQSZQDDI-SESCQDRSSA-M
SMILES CCCCCCCC(CC(=O)OC(CCCCCCC)CC([O-])=O)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate (CHEBI:62522) is a monocarboxylic acid anion (CHEBI:35757)
2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate (CHEBI:62522) is conjugate base of 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoic acid (CHEBI:62570)
Incoming 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoic acid (CHEBI:62570) is conjugate acid of 2-O-α-L-rhamnosyl-α-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate (CHEBI:62522)
IUPAC Name
3-[(3-{[6-deoxy-2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy}decanoyl)oxy]decanoate
Synonyms Sources
2-O-rhamnopyranosyl-rhamnopyranosyl-3-hydroxyldecanoyl-3-hydroxydecanoate (1−) SUBMITTER
L-rhamnosyl-L-rhamnosyl-3-hydroxydecanoyl-3-hydroxydecanoate(1−) ChEBI
RHAMNOLIPID R-1 SUBMITTER
Last Modified
08 July 2011