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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H31NO3.ClH
Molecular Weight 393.947
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SONGORINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12C[C@]3([C@H](O)C1=C)[C@@]4([H])C[C@@]5([H])[C@@]6([C@@H](O)CC[C@@]5(C)CN(CC)[C@]46[H])[C@]3([H])CC2=O

InChI

InChIKey=OBBXHDIDARFQEV-SRVKNAIVSA-N
InChI=1S/C22H31NO3.ClH/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22;/h12-13,15-19,25-26H,2,4-10H2,1,3H3;1H/t12-,13+,15-,16-,17+,18-,19-,20+,21+,22+;/m1./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C22H31NO3
Molecular Weight 357.4864
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:48:07 UTC 2023
Edited
by admin
on Sat Dec 16 10:48:07 UTC 2023
Record UNII
48543X080T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SONGORINE HYDROCHLORIDE
MI  
Common Name English
SONGORINE HYDROCHLORIDE [MI]
Common Name English
BULLATINE G HYDROCHLORIDE
Common Name English
NAPELLONINE HYDROCHLORIDE
Common Name English
12,3,6A-ETHANYLYLIDENE-9,11A-METHANOAZULENO(2,1-B)AZOCIN-8(9H)-ONE, 1-ETHYLDODECAHYDRO-6,11-DIHYDROXY-3-METHYL-10-METHYLENE-, HYDROCHLORIDE, (3R-(3.ALPHA.,6.BETA.,6A.ALPHA.,6B.ALPHA.,9.BETA.,11.ALPHA.,11A.BETA.,12.ALPHA.,12A.BETA.,14R*))-
Systematic Name English
12,3,6A-ETHANYLYLIDENE-9,11A-METHANOAZULENO(2,1-B)AZOCIN-8(9H)-ONE, 1-ETHYLDODECAHYDRO-6,11-DIHYDROXY-3-METHYL-10-METHYLENE-, HYDROCHLORIDE, (3R,6S,6AR,6BR,9R,11R,11AR,12R,12AR,14R)-
Systematic Name English
7,20-CYCLOVEATCHAN-12-ONE, 21-ETHYL-1,15-DIHYDROXY-4-METHYL-16-METHYLENE-, HYDROCHLORIDE, (1.ALPHA.,15.BETA.)-
Systematic Name English
Code System Code Type Description
MERCK INDEX
m10113
Created by admin on Sat Dec 16 10:48:07 UTC 2023 , Edited by admin on Sat Dec 16 10:48:07 UTC 2023
PRIMARY Merck Index
PUBCHEM
86278186
Created by admin on Sat Dec 16 10:48:07 UTC 2023 , Edited by admin on Sat Dec 16 10:48:07 UTC 2023
PRIMARY
CAS
51064-89-2
Created by admin on Sat Dec 16 10:48:07 UTC 2023 , Edited by admin on Sat Dec 16 10:48:07 UTC 2023
PRIMARY
FDA UNII
48543X080T
Created by admin on Sat Dec 16 10:48:07 UTC 2023 , Edited by admin on Sat Dec 16 10:48:07 UTC 2023
PRIMARY