(Q27106906)

2-Benzoyl-3,5-dihydroxy-4-{[(1R,2S,5S)-2-hydroxy-5-isopropenyl-2-methylcyclopentyl]methyl}-6,6-bis(3-methyl-2-buten-1-yl)-2,4-cyclohexadien-1-one (English)

retrieved

5 October 2016

chemical formula

C₃₃H₄₂O₅

0 references

canonical SMILES

CC(C)=CCC1(CC=C(C)C)C(=C(CC2(C(CCC2(C)O)(C(=C)C)[H])[H])C(=C(C(C3=CC=CC=C3)=O)C1=O)O)O

1 reference

language of work or name

English

title

Hypercalin B (English)

retrieved

5 October 2016

isomeric SMILES

CC(C)=CCC1(CC=C(C)C)C(=C(C[C@@]2([C@](CC[C@]2(C)O)(C(=C)C)[H])[H])C(=C(C(C3=CC=CC=C3)=O)C1=O)O)O

1 reference

language of work or name

English

title

Hypercalin B (English)

5 October 2016

2 references

Tomoeones A-H, cytotoxic phloroglucinol derivatives from Hypericum ascyron

stated in

Tomoeones A-H, cytotoxic phloroglucinol derivatives from Hypericum ascyron

Hypericum beanii

1 reference

stated in

Spirocyclic acylphloroglucinol derivatives from Hypericum beanii

Identifiers

InChI

InChI=1S/C33H42O5/c1-20(2)13-17-33(18-14-21(3)4)30(36)25(19-26-24(22(5)6)15-16-32(26,7)38)29(35)27(31(33)37)28(34)23-11-9-8-10-12-23/h8-14,24,26,35-36,38H,5,15-19H2,1-4,6-7H3/t24-,26-,32+/m1/s1

1 reference

language of work or name

English

title

Hypercalin B (English)

retrieved

5 October 2016

InChIKey

NTCBJJMOLYDOIE-OKQRBPQJSA-N

2 references

language of work or name

English

title

Hypercalin B (English)

retrieved

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

language of work or name

English

title

Hypercalin B (English)

5 October 2016

1 reference

language of work or name

English

title

2-Benzoyl-3,5-dihydroxy-4-{[(1R,2S,5S)-2-hydroxy-5-isopropenyl-2-methylcyclopentyl]methyl}-6,6-bis(3-methyl-2-buten-1-yl)-2,4-cyclohexadien-1-one (English)

retrieved

5 October 2016

ChEBI ID

5833

mapping relation type

2 references

language of work or name