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MICROCYSTIN YR

MICROCYSTIN YR structure

CAS No:
101064-48-6
Formula:
C52H72N10O13
Chemical Name:
MICROCYSTIN YR
Synonyms:
MICROCYSTIN YR;microcystin yr from microcystis aeruginosa;MICROCYSTIN-YR SOLUTION;Cyanoginosin la, 3-L-tyrosine-5-L-arginine;Cyanoginosin la, 3-L-tyrosyl-5-L-arginine;Cyanoginosin la, 3-tyrosyl-5-arginine-;Cyanoginosin yr;Cyanoginosin-yr
Categories:
Analytical Chemistry > Standard

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MICROCYSTIN YR Basic Attributes

Molecular Weight：

1045.19

Exact Mass：

1044.528076

EC Number：

200-659-6

UNII：

4G08121T5U

Characteristics

PSA：

363

XLogP3：

-1.85

Appearance：

white powder

Density：

1.33±0.1 g/cm3(Predicted)

Flash Point：

11 °C

Refractive Index：

1.615

Water Solubility：

methanol: 2 mg/mL (further dilute to 10% (v/v) methanol)

Storage Conditions：

−20°C

Chemical Classes：

Microcystin

Safety Information

Transport codes：

UN 2811 6.1/PG 1

wgk germany：

hazard class code：

26/27/28-36/37/38-43-39/23/24/25-23/24/25-11

safety instructions：

26-36/37/39-45-36/37-16-7

RTECS Number：

000000030272

Marks：

T+,T,F

Precautionary statement(s)：

P260-P264-P280-P284-P301 + P310-P302 + P350

Hazard Statements：

H300-H310-H315-H317-H319-H330-H335

GHS Classification：

|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P260, P261, P262, P264, P270, P271, P272, P280, P284, P301+P310, P302+P350, P302+P352, P304+P340, P305+P351+P338, P310, P312, P320, P321, P322, P330, P332+P313, P333+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

cyanoginosin LA, 3-tyrosyl-5-arginine-

Computed Properties

Molecular Weight:1045.2
XLogP3:2.2
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:15
Exact Mass:1044.52803239
Monoisotopic Mass:1044.52803239
Topological Polar Surface Area:363
Heavy Atom Count:75
Complexity:2110
Defined Atom Stereocenter Count:10
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes