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Details

Stereochemistry ACHIRAL
Molecular Formula C18H27NO6
Molecular Weight 353.4101
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISLINE

SMILES

[H][C@]12CCN3CC=C(COC(=O)[C@@](C)(O)[C@H](C)C[C@](O)(CC)C(=O)O1)[C@]23[H]

InChI

InChIKey=QZJRTVIGIAAJPX-GPBKISAOSA-N
InChI=1S/C18H27NO6/c1-4-18(23)9-11(2)17(3,22)15(20)24-10-12-5-7-19-8-6-13(14(12)19)25-16(18)21/h5,11,13-14,22-23H,4,6-10H2,1-3H3/t11-,13-,14-,17+,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H27NO6
Molecular Weight 353.4101
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:54:39 GMT 2023
Edited
by admin
on Fri Dec 15 18:54:39 GMT 2023
Record UNII
T4ALZ3HDK8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISLINE
Common Name English
(1,6)DIOXACYCLODODECINO(2,3,4-GH)PYRROLIZINE-2,7-DIONE, 3-ETHYL-3,4,5,6,9,11,13,14,14A,14B-DECAHYDRO-3,6-DIHYDROXY-5,6-DIMETHYL-, (3R,5R,6S,14AR,14BR)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30952624
Created by admin on Fri Dec 15 18:54:39 GMT 2023 , Edited by admin on Fri Dec 15 18:54:39 GMT 2023
PRIMARY
FDA UNII
T4ALZ3HDK8
Created by admin on Fri Dec 15 18:54:39 GMT 2023 , Edited by admin on Fri Dec 15 18:54:39 GMT 2023
PRIMARY
PUBCHEM
181990
Created by admin on Fri Dec 15 18:54:39 GMT 2023 , Edited by admin on Fri Dec 15 18:54:39 GMT 2023
PRIMARY
CAS
30258-28-7
Created by admin on Fri Dec 15 18:54:39 GMT 2023 , Edited by admin on Fri Dec 15 18:54:39 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE