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Substance Name: Phosphotyrosylangiotensin II
RN: 129785-85-9
InChIKey: SIDJRUMTBNGMRF-JZXHSEFVSA-N

Note

  • Used for tyrosylphosphorylation of angiotensin II.

Molecular Formula

  • C50-H72-N13-O15-P

Molecular Weight

  • 1126.1688
 
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Names and Synonyms

Name of Substance

  • Phosphotyrosylangiotensin II

Synonyms

  • 4-Tyr(P)-angiotensin II
  • Angiotensin II, O-phosphotyrosyl(4)-
  • Angiotensin II, tyr(P)(4)-
  • Pptyr-aii

Systematic Name

  • Angiotensin II, 5-L-isoleucine-, dihydrogen phosphate (ester)

Registry Numbers

CAS Registry Number

  • 129785-85-9

System Generated Number

  • 0129785859

Structure Descriptors

InChI

1S/C50H72N13O15P/c1-5-28(4)41(47(71)59-36(23-31-25-54-26-56-31)48(72)63-20-10-14-38(63)45(69)60-37(49(73)74)22-29-11-7-6-8-12-29)62-44(68)35(21-30-15-17-32(18-16-30)78-79(75,76)77)58-46(70)40(27(2)3)61-43(67)34(13-9-19-55-50(52)53)57-42(66)33(51)24-39(64)65/h6-8,11-12,15-18,25-28,33-38,40-41H,5,9-10,13-14,19-24,51H2,1-4H3,(H,54,56)(H,57,66)(H,58,70)(H,59,71)(H,60,69)(H,61,67)(H,62,68)(H,64,65)(H,73,74)(H4,52,53,55)(H2,75,76,77)/t28-,33-,34-,35-,36-,37-,38-,40-,41-/m0/s1

InChIKey

SIDJRUMTBNGMRF-JZXHSEFVSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3ccccc3)C(=O)O)NC(=O)[C@H](Cc4ccc(cc4)OP(=O)(O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)N