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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H31NO6
Molecular Weight 381.464
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SYMPHYTINE

SMILES

C/C(/[H])=C(\C)/C(=O)O[C@]1([H])CCN2CC=C(COC(=O)[C@](C(C)C)([C@]([H])(C)O)O)[C@]12[H]

InChI

InChIKey=MVWPTZQHBOWRTF-SMLWLWDZSA-N
InChI=1S/C20H31NO6/c1-6-13(4)18(23)27-16-8-10-21-9-7-15(17(16)21)11-26-19(24)20(25,12(2)3)14(5)22/h6-7,12,14,16-17,22,25H,8-11H2,1-5H3/b13-6+/t14-,16+,17+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H31NO6
Molecular Weight 381.464
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 07:48:18 UTC 2021
Edited
by admin
on Sat Jun 26 07:48:18 UTC 2021
Record UNII
3K8W67TIDS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SYMPHYTINE
Common Name English
SYMPHYTINE [IARC]
Common Name English
2-BUTENOIC ACID, 2-METHYL-, (1R,7AR)-7-(((2S,3S)-2,3-DIHYDROXY-2-(1-METHYLETHYL)-1-OXOBUTOXY)METHYL)-2,3,5,7A-TETRAHYDRO-1H-PYRROLIZIN-1-YL ESTER, (2E)-
Systematic Name English
7-TIGLYL-9-VIRIDIFLORYLRETRONECINE
Common Name English
7-TIGLYLRETRONECINE VIRIDIFLORATE
Common Name English
Code System Code Type Description
FDA UNII
3K8W67TIDS
Created by admin on Sat Jun 26 07:48:18 UTC 2021 , Edited by admin on Sat Jun 26 07:48:18 UTC 2021
PRIMARY
CAS
22571-95-5
Created by admin on Sat Jun 26 07:48:18 UTC 2021 , Edited by admin on Sat Jun 26 07:48:18 UTC 2021
PRIMARY
PUBCHEM
5281754
Created by admin on Sat Jun 26 07:48:18 UTC 2021 , Edited by admin on Sat Jun 26 07:48:18 UTC 2021
PRIMARY
EPA CompTox
22571-95-5
Created by admin on Sat Jun 26 07:48:18 UTC 2021 , Edited by admin on Sat Jun 26 07:48:18 UTC 2021
PRIMARY
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