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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > carbopolycyclic compound > carbobicyclic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > carbopolycyclic compound > carbobicyclic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > tetralins > (3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one

Preferred term

(3s,6ar,7r,12r,12as)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2h-benzo[a]anthracen-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22O6

inchi

  • InChI=1S/C20H22O6/c1-19(24)8-10-6-7-20(25)16(14(10)12(21)9-19)17(22)11-4-3-5-13(26-2)15(11)18(20)23/h3-7,16-18,22-25H,8-9H2,1-2H3/t16-,17-,18+,19-,20+/m0/s1

inchikey

  • FIAHDCXBPGRVEK-UHZRXMQZSA-N

mass

  • 358.390

monoisotopicmass

  • 358.14164

smiles

  • O=C1C2=C(C=C[C@]3([C@@H]2[C@@H](O)C=4C=CC=C(C4[C@H]3O)OC)O)C[C@@](C1)(O)C

subset

  • 2_STAR

synonym EXACT

  • (3S,6aR,7R,12R,12aS)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2H-benzo[a]anthracen-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225375

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