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 No supplier information found for this compound.
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