(Q27147370)

3-[(1R,2S,4aS,7S,8aS)-4,7-dimethyl-1-[(E)-prop-1-enyl]-1,2,4a,5,6,7,8,8a-octahydronaphthalene-2-carbonyl]-4-hydroxy-5-(4-hydroxyphenyl)-1H-pyridin-2-one

Ilicicolin H (English)

8 October 2016

1 reference

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₁NO₄

1 reference

Ilicicolin H (English)

8 October 2016

canonical SMILES

CC=CC1C2CC(CCC2C(=CC1C(=O)C3=C(C(=CNC3=O)C4=CC=C(C=C4)O)O)C)C

1 reference

Ilicicolin H (English)

8 October 2016

isomeric SMILES

C/C=C/[C@@H]1[C@H]2C[C@H](CC[C@@H]2C(=C[C@H]1C(=O)C3=C(C(=CNC3=O)C4=CC=C(C=C4)O)O)C)C

1 reference

Ilicicolin H (English)

Structure of ilicocolin H, an antifungal antibiotic

8 October 2016

found in taxon

Calonectria pyrochroa

1 reference

stated in

Identifiers

InChI

InChI=1S/C27H31NO4/c1-4-5-20-21-12-15(2)6-11-19(21)16(3)13-22(20)25(30)24-26(31)23(14-28-27(24)32)17-7-9-18(29)10-8-17/h4-5,7-10,13-15,19-22,29H,6,11-12H2,1-3H3,(H2,28,31,32)/b5-4+/t15-,19+,20+,21-,22+/m0/s1

1 reference

Ilicicolin H (English)

8 October 2016

2 references

Ilicicolin H (English)

8 October 2016

stated in

ChEBI release 2020-09-01

1 reference

ilicicolin H (English)

8 October 2016

2 references

Ilicicolin H (English)

8 October 2016

Reaxys registry number

1631061

1 reference

ilicicolin H (English)

8 October 2016

ChEBI ID

77772

mapping relation type

2 references

ilicicolin H (English)

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H31NO4/c1-4-5-20-21-12-15(2)6-11-19(21)16(3)13-22(20)25(30)24-26(31)23(14-28-27(24)32)17-7-9-18(29)10-8-17/h4-5,7-10,13-15,19-22,29H,6,11-12H2,1-3H3,(H2,28,31,32)/b5-4+/t15-,19+,20+,21-,22+/m0/s1

1 reference

ILICICOLIN H (English)

8 October 2016

1 reference

1 reference

Natural Product Atlas ID

NPA013324

2 references

based on heuristic

inferred from InChIKey