CHEBI:66782 - Protoxylocarpin C

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ChEBI Name Protoxylocarpin C
ChEBI ID CHEBI:66782
Definition A natural product found in Xylocarpus granatum.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C34H54O6
Net Charge 0
Average Mass 558.78900
Monoisotopic Mass 558.39204
InChI InChI=1S/C34H54O6/c1-10-38-29-20(18-22(40-29)28(37)31(5,6)39-11-2)21-12-13-23-32(21,7)16-14-24-33(8)17-15-26(35)30(3,4)25(33)19-27(36)34(23,24)9/h13,15,17,20-22,24-25,27-29,36-37H,10-12,14,16,18-19H2,1-9H3/t20-,21-,22+,24+,25-,27+,28+,29+,32-,33+,34-/m0/s1
InChIKey OFUNGYZREUEBNU-YCDMDWGMSA-N
SMILES [H][C@@]1(C[C@]([H])([C@H](OCC)O1)[C@]1([H])CC=C2[C@@]1(C)CC[C@@]1([H])[C@@]2(C)[C@H](O)C[C@@]2([H])C(C)(C)C(=O)C=C[C@]12C)[C@@H](O)C(C)(C)OCC
Metabolite of Species Details
Xylocarpus granatum (NCBI:txid241841) Found in rind (BTO:0001184). Dried fruit rinds See: DOI
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Protoxylocarpin C (CHEBI:66782) has role metabolite (CHEBI:25212)
Protoxylocarpin C (CHEBI:66782) is a limonoid (CHEBI:39434)
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:cholanoid(CHEBI:36078); ISA:3-oxo steroid(CHEBI:47788); ISA:7-hydroxy steroid(CHEBI:36844); ISA:3-oxo Delta(1)-steroid(CHEBI:20156); ISA:steroid(CHEBI:35341); ISA:monosaccharide(CHEBI:35381); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:oxolanes(CHEBI:26912); ISA:organic hydroxy compound(CHEBI:33822); ISA:cyclic ketone(CHEBI:3992); ISA:secondary alcohol(CHEBI:35681); ISA:acetal(CHEBI:59769); ISA:ether(CHEBI:25698);