(Q27133952)

Biyouyanagin A (English)

(1'R,2'R,3S,4S,6'S,7'R,8'S)-4-ethenyl-4,11'-dimethyl-8'-[(2R)-6-methylhept-5-en-2-yl]-2'-phenyl-3'-oxaspiro[oxolane-3,4'-tricyclo[5.4.0.0²,⁶]undecan]-10'-ene-2,5'-dione

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,2R,4S,4'R,6S,7R,8S)-4'-ethenyl-4',11-dimethyl-8-[(2R)-6-methylhept-5-en-2-yl]-2-phenylspiro[3-oxatricyclo[5.4.0.02,6]undec-10-ene-4,3'-oxolane]-2',5-dione

2 references

based on heuristic

inferred from InChIKey

1 reference

C₃₁H₃₈O₄

1 reference

Biyouyanagin A (English)

7 October 2016

canonical SMILES

CC1=CCC(C2C1C3(C2C(=O)C4(O3)C(=O)OCC4(C)C=C)C5=CC=CC=C5)C(C)CCC=C(C)C

1 reference

Biyouyanagin A (English)

7 October 2016

isomeric SMILES

CC1=CC[C@@H]([C@H]2[C@@H]1[C@@]3([C@H]2C(=O)[C@@]4(O3)C(=O)OC[C@@]4(C)C=C)C5=CC=CC=C5)[C@H](C)CCC=C(C)C

1 reference

Biyouyanagin A (English)

Cratoxylum cochinchinense

7 October 2016

found in taxon

1 reference

Biyouyanagin A, an anti-HIV agent from Hypericum chinense L. var. salicifolium

Hypericum chinense

1 reference

Biyouyanagin A, an anti-HIV agent from Hypericum chinense L. var. salicifolium

Hypericum monogynum

1 reference

Biyouyanagin A, an anti-HIV agent from Hypericum chinense L. var. salicifolium

Hypericum japonicum

1 reference

Biyouyanagin A, an anti-HIV agent from Hypericum chinense L. var. salicifolium

Identifiers

InChI

InChI=1S/C31H38O4/c1-7-29(6)18-34-28(33)31(29)27(32)26-24-23(20(4)13-11-12-19(2)3)17-16-21(5)25(24)30(26,35-31)22-14-9-8-10-15-22/h7-10,12,14-16,20,23-26H,1,11,13,17-18H2,2-6H3/t20-,23-,24+,25-,26-,29-,30-,31-/m1/s1

1 reference

Biyouyanagin A (English)

HPOOJUSGIAKESV-FUPDMQGESA-N

7 October 2016

InChIKey

2 references

Biyouyanagin A (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

(2R,3aS,3bS,4R,4'R,7aS,7bR)-4',7-Dimethyl-4-[(2R)-6-methyl-5-hepten-2-yl]-7b-phenyl-4'-vinyl-3a,3b,4,4',5,5',7a,7b-octahydro-3H-spiro[benzo[3,4]cyclobuta[1,2-b]furan-2,3'-furan]-2',3-dione (English)

7 October 2016

2 references