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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20N2O
Molecular Weight 256.3428
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FUMIGACLAVINE B

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)[C@@]1([H])[C@@H](O)[C@H](C)CN2C

InChI

InChIKey=JUXRVSRUBIFVKE-BBDZHYCFSA-N
InChI=1S/C16H20N2O/c1-9-8-18(2)13-6-10-7-17-12-5-3-4-11(14(10)12)15(13)16(9)19/h3-5,7,9,13,15-17,19H,6,8H2,1-2H3/t9-,13-,15-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H20N2O
Molecular Weight 256.3428
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:26:35 UTC 2023
Edited
by admin
on Sat Dec 16 17:26:35 UTC 2023
Record UNII
TBQ33F7DSR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FUMIGACLAVINE B
Common Name English
(6aR,9R,10S,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-10-ol
Systematic Name English
(8α,9β)-6,8-Dimethylergolin-9-ol
Systematic Name English
(2R,3S,4R,7R)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0{2,7}.0{12,16}]hexadeca-1(15),9,12(16),13-tetraen-3-ol
Systematic Name English
Code System Code Type Description
PUBCHEM
21589072
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID201017505
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY
CAS
6879-93-2
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY
CHEBI
67146
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY
WIKIPEDIA
Fumigaclavine B
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY
FDA UNII
TBQ33F7DSR
Created by admin on Sat Dec 16 17:26:35 UTC 2023 , Edited by admin on Sat Dec 16 17:26:35 UTC 2023
PRIMARY