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TOCINOICACID

TOCINOICACID structure

CAS No:
34330-23-9
Formula:
C30H44N8O10S2
Chemical Name:
TOCINOICACID
Synonyms:
CYS-TYR-ILE-GLN-ASN-CYS;(ILE3)-PRESSINOIC ACID;H-CYS-TYR-ILE-GLN-ASN-CYS-OH;TOCINOIC ACID;TOCINOIC ACID (CYS-TYR-ILE-GLN-ASN-CYS);Oxytocin, 7-de-L-proline-8-de-L-leucine-9-deglycinamide-;3-PRESSINOIC ACID;CYS-TYR-ILE-GLN-ASN-CYS: CYIQNCDISULFIDE BRIDGE CYS1-CYS6
Categories:
Pharmaceutical Intermediates > Anticonvulsants

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TOCINOICACID Basic Attributes

Molecular Weight：

740.85

Exact Mass：

740.26218198

Characteristics

Density：

1.288±0.06 g/cm3

Boiling Point：

1326.4±65.0 °C(Predicted)

PKA：

2.94±0.70

Safety Information

wgk germany：

Drug Information

MeSH Entry Terms：

7-de-Pro-3-de-Leu-3-de-GlyNH2-deoxytocin

Computed Properties

Molecular Weight:740.9
XLogP3:-4.7
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:10
Exact Mass:740.26218198
Monoisotopic Mass:740.26218198
Topological Polar Surface Area:366
Heavy Atom Count:50
Complexity:1250
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes