DESMOSINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H40N5O8
Molecular Weight	526.6031
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

N[C@@H](CCCC[N+]1=CC(CC[C@H](N)C(O)=O)=C(CCC[C@H](N)C(O)=O)C(CC[C@H](N)C(O)=O)=C1)C(O)=O

InChI

InChIKey=VEVRNHHLCPGNDU-MUGJNUQGSA-O

InChI=1S/C24H39N5O8/c25-17(21(30)31)5-1-2-11-29-12-14(7-9-19(27)23(34)35)16(4-3-6-18(26)22(32)33)15(13-29)8-10-20(28)24(36)37/h12-13,17-20H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37)/p+1/t17-,18-,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H39N5O8
Molecular Weight	525.5952
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 10:08:02 GMT 2023` Edited by `admin` on `Sat Dec 16 10:08:02 GMT 2023`
Record UNII	4MOL2J0TLY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DESMOSINE

Common Name

English

DESMOSINE CATION

Common Name

English

DESMOSINE, (+)-

Common Name

English

6-(4-((4S)-4-AMINO-4-CARBOXYBUTYL)-3,5-BIS((3S)-3-AMINO-3-CARBOXYPROPYL)-1-PYRIDINIUMYL)-L-NORLEUCINE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C73539