(Q27137158)

English

prochaetoglobosin I

chemical compound

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

cytochalasan alkaloid

0 references

482.293328±0 dalton

1 reference

language of work or name

CHEBI:68739 (English)

7 October 2016

stereoisomer of

prochaetoglobosin I

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,3E,7Z,9S,11E,13S,16S,17R,18S)-18-(1H-indol-3-ylmethyl)-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-3,7,11,14-tetraene-2,20-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₃₈N₂O₂

1 reference

language of work or name

CHEBI:68739 (English)

7 October 2016

canonical SMILES

CC1CC=CC2C=C(C(C3C2(C(=O)C=CCCC(=C1)C)C(=O)NC3CC4=CNC5=CC=CC=C54)C)C

1 reference

language of work or name

CHEBI:68739 (English)

7 October 2016

isomeric SMILES

C[C@H]\1C/C=C/[C@H]2C=C([C@H]([C@@H]3[C@@]2(C(=O)/C=C\CC/C(=C1)/C)C(=O)N[C@H]3CC4=CNC5=CC=CC=C54)C)C

1 reference

language of work or name

CHEBI:68739 (English)

7 October 2016

Chaetomium subaffine

2 references

New plausible precursors of chaetoglobosin a accumulated by treatment of chaetomium subaffine with cytochrome P-450 inhibitors

Useful approach to find the plausible biosynthetic precursors of secondary metabolites using P-450 inhibitors: postulated intermediates of chaetoglobosin A

Identifiers

InChI=1S/C32H38N2O2/c1-20-10-5-8-15-29(35)32-25(12-9-11-21(2)16-20)17-22(3)23(4)30(32)28(34-31(32)36)18-24-19-33-27-14-7-6-13-26(24)27/h6-9,12-17,19,21,23,25,28,30,33H,5,10-11,18H2,1-4H3,(H,34,36)/b12-9+,15-8-,20-16+/t21-,23+,25-,28-,30-,32+/m0/s1

1 reference

language of work or name

CHEBI:68739 (English)

7 October 2016

PAFRQNXHHHYHMF-YOJZVGJQSA-N

2 references

language of work or name

CHEBI:68739 (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

1 reference

language of work or name

prochaetoglobosin I (English)

7 October 2016

1 reference

language of work or name

(3S,3aR,4S,6aS,7E,10S,11E,15Z,17aS)-3-(1H-Indol-3-ylmethyl)-4,5,10,12-tetramethyl-3,3a,4,6a,9,10,13,14-octahydro-1H-cyclotrideca[d]isoindole-1,17(2H)-dione (English)

7 October 2016

2 references

language of work or name

CHEBI:68739 (English)

7 October 2016

matched by identifier from

PAFRQNXHHHYHMF-YOJZVGJQSA-N

Reaxys registry number

4831106

1 reference

language of work or name

prochaetoglobosin I (English)

7 October 2016

mapping relation type

2 references

language of work or name

prochaetoglobosin I (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C32H38N2O2/c1-20-10-5-8-15-29(35)32-25(12-9-11-21(2)16-20)17-22(3)23(4)30(32)28(34-31(32)36)18-24-19-33-27-14-7-6-13-26(24)27/h6-9,12-17,19,21,23,25,28,30,33H,5,10-11,18H2,1-4H3,(H,34,36)/b12-9+,15-8-,20-16+/t21-,23+,25-,28-,30-,32+/m0/s1

UniChem compound ID

1 reference

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