skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > benzophenones > acremonidin c
... > 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 > ketone > aromatic ketone > benzophenones > acremonidin c
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > benzophenones > acremonidin c

Preferred term

acremonidin c  

Type

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

Broader concept

charge

  • 0

formula

  • C33H26O13

inchi

  • InChI=1S/C33H26O13/c1-12-8-16-22(19(37)9-12)29(42)33(44)28(41)15-6-7-32(33,30(16)46-13(2)34)11-14-10-20(38)25(26(39)21(14)15)27(40)23-17(35)4-5-18(36)24(23)31(43)45-3/h4-10,15,30,35-39,44H,11H2,1-3H3/t15-,30-,32+,33?/m0/s1

inchikey

  • SABTZTAQTOWIRM-KSKMTRDGSA-N

mass

  • 630.558

monoisotopicmass

  • 630.13734

smiles

  • O=C1C2=C(O)C=C(C)C=C2[C@H](OC(=O)C)[C@]34C1(O)C(=O)[C@H](C=5C(O)=C(C(=O)C6=C(C(O)=CC=C6O)C(=O)OC)C(=CC5C3)O)C=C4

subset

  • 2_STAR

synonym EXACT

  • methyl 2-[(1S,2S,12S)-2-acetyloxy-7,10,14,16-tetrahydroxy-5-methyl-9,11-dioxopentacyclo[10.7.2.01,10.03,8.013,18]henicosa-3(8),4,6,13,15,17,20-heptaene-15-carbonyl]-3,6-dihydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216072

Download this concept:

RDF/XML TURTLE JSON-LD