Name: (D-ALA7)-ANGIOTENSIN I/II (1-7)
SKU: 159432-28-7

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Basic Information

Molecular Structure:
CAS No.:	159432-28-7
Name:	(D-ALA7)-ANGIOTENSIN I/II (1-7)

Formula:	C₃₉H₆₀N₁₂O₁₁
Molecular Weight:	872.97
Synonyms:	AngiotensinII, 5-L-isoleucine-7-D-alanine-8-de-L-phenylalanine-;1: PN: WO2008089532 PAGE:46 claimed protein;A 779;
Density:	1.457 g/cm³
PSA:	386.03000
LogP:	1.91780

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Specification

The 1-7-Angiotensin II,5-L-isoleucine-7-D-alanine- is an organic compound with the formula C₃₉H₆₀N₁₂O₁₁. The systematic name of this chemical is L-α-Aspartyl-N5-(diaminomethylidene)-L-ornithyl-L-valyl-L-tyrosyl-L-isoleucyl-L-histidyl-D-alanine. The CAS registry number of this chemical is 159432-28-7. Besides, it should be stored at -15 °C.

Physical properties about 1-7-Angiotensin II,5-L-isoleucine-7-D-alanine- are: (1)ACD/LogP: -0.56; (2)# of Rule of 5 Violations: 3; (3)#H bond acceptors: 23; (4)#H bond donors: 16; (5)#Freely Rotating Bonds: 28; (6)Polar Surface Area: 388.53 Å²; (7)Index of Refraction: 1.651; (8)Molar Refractivity: 218.875 cm³; (9)Molar Volume: 599.259 cm³; (10)Polarizability: 86.769×10^-24 cm³; (11)Surface Tension: 60.994 dyne/cm; (12)Density: 1.457 g/cm³.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C39H60N12O11/c1-6-20(4)31(37(60)49-28(15-23-17-43-18-45-23)34(57)46-21(5)38(61)62)51-35(58)27(14-22-9-11-24(52)12-10-22)48-36(59)30(19(2)3)50-33(56)26(8-7-13-44-39(41)42)47-32(55)25(40)16-29(53)54/h9-12,17-21,25-28,30-31,52H,6-8,13-16,40H2,1-5H3,(H,43,45)(H,46,57)(H,47,55)(H,48,59)(H,49,60)(H,50,56)(H,51,58)(H,53,54)(H,61,62)(H4,41,42,44)/t20-,21+,25-,26-,27-,28-,30-,31-/m0/s1
(2)InChIKey: GZSZZUXDAPDPOR-NGIFJXEWBR
(3)Std. InChI: InChI=1S/C39H60N12O11/c1-6-20(4)31(37(60)49-28(15-23-17-43-18-45-23)34(57)46-21(5)38(61)62)51-35(58)27(14-22-9-11-24(52)12-10-22)48-36(59)30(19(2)3)50-33(56)26(8-7-13-44-39(41)42)47-32(55)25(40)16-29(53)54/h9-12,17-21,25-28,30-31,52H,6-8,13-16,40H2,1-5H3,(H,43,45)(H,46,57)(H,47,55)(H,48,59)(H,49,60)(H,50,56)(H,51,58)(H,53,54)(H,61,62)(H4,41,42,44)/t20-,21+,25-,26-,27-,28-,30-,31-/m0/s1
(4)Std. InChIKey: GZSZZUXDAPDPOR-NGIFJXEWSA-N