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Chemistry, part 2

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Concept information

organooxygen compound > polyketide > macrolide > borrelidin d
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin d
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin d
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > borrelidin d
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > borrelidin d

Preferred term

borrelidin d  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C28H43NO7

inchi

  • InChI=1S/C28H43NO7/c1-16-9-17(2)11-19(4)27(33)20(15-29)7-5-6-8-25(22-12-21(30)13-23(22)28(34)35)36-26(32)14-24(31)18(3)10-16/h5-7,16-19,21-25,27,30-31,33H,8-14H2,1-4H3,(H,34,35)/t16-,17+,18-,19-,21+,22+,23+,24-,25-,27+/m0/s1

inchikey

  • XPAMOXHOVDBZNA-OVBRKWQWSA-N

mass

  • 505.652

monoisotopicmass

  • 505.30395

smiles

  • O=C1O[C@H]([C@H]2[C@H](C(=O)O)C[C@@H](C2)O)CC=CC=C(C#N)[C@H](O)[C@@H](C)C[C@@H](C[C@@H](C[C@@H]([C@H](C1)O)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,4R)-2-[(2S,8R,9S,11R,13S,15S,16S)-7-cyano-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6-dien-2-yl]-4-hydroxycyclopentane-1-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212658

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