Search MNXref
 Feedback

angiotensin II

PropertiesImage
MNX_IDMNXM3036 Image of MNXM3036
referencechebi:58506
formulaC50H71N13O12
global charge0
mol weight1046.197
InChIKeyCZGUSIXMZVURDU-JZXHSEFVSA-N
InChIInChI=1S/C50H71N13O12/c1-5-28(4)41(47(72)59-36(23-31-25-54-26-56-31)48(73)63-20-10-14-38(63)45(70)60-37(49(74)75)22-29-11-7-6-8-12-29)62-44(69)35(21-30-15-17-32(64)18-16-30)58-46(71)40(27(2)3)61-43(68)34(13-9-19-55-50(52)53)57-42(67)33(51)24-39(65)66/h6-8,11-12,15-18,25-28,33-38,40-41,64H,5,9-10,13-14,19-24,51H2,1-4H3,(H,54,56)(H,57,67)(H,58,71)(H,59,72)(H,60,70)(H,61,68)(H,62,69)(H,65,66)(H,74,75)(H4,52,53,55)/t28-,33-,34-,35-,36-,37-,38-,40-,41-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=[NH2+])NC(=O)[C@@H]([NH3+])CC(=O)[O-])C(C)C)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C50H71N13O12/c1-5-28(4)41(47(72)59-36(23-31-25-54-26-56-31)48(73)63-20-10-14-38(63)45(70)60-37(49(74)75)22-29-11-7-6-8-12-29)62-44(69)35(21-30-15-17-32(64)18-16-30)58-46(71)40(27(2)3)61-43(68)34(13-9-19-55-50(52)53)57-42(67)33(51)24-39(65)66/h6-8,11-12,15-18,25-28,33-38,40-41,64H,5,9-10,13-14,19-24,51H2,1-4H3,(H,54,56)(H,57,67)(H,58,71)(H,59,72)(H,60,70)(H,61,68)(H,62,69)(H,65,66)(H,74,75)(H4,52,53,55)/t28-,33-,34-,35-,36-,37-,38-,40-,41-/m0/s1 Image of MNXM3036
SMILES (mnx)[CH3:1][CH2:5][C@H:28]([CH3:4])[C@@H:41]([C:47](=[N:59][C@@H:36]([CH2:23][C:31]1=[CH:25][N:54]=[CH:26][NH:56]1)[C:48]([N:63]1[CH2:20][CH2:10][CH2:14][C@H:38]1[C:45](=[N:60][C@@H:37]([CH2:22][C:29]1=[CH:11][CH:7]=[CH:6][CH:8]=[CH:12]1)[C:49](=[O:74])[OH:75])[OH:70])=[O:73])[OH:72])[N:62]=[C:44]([C@H:35]([CH2:21][C:30]1=[CH:16][CH:18]=[C:32]([OH:64])[CH:17]=[CH:15]1)[N:58]=[C:46]([C@H:40]([CH:27]([CH3:2])[CH3:3])[N:61]=[C:43]([C@H:34]([CH2:13][CH2:9][CH2:19][NH:55][C:50](=[NH:52])[NH2:53])[N:57]=[C:42]([C@H:33]([CH2:24][C:39](=[O:65])[OH:66])[NH2:51])[OH:67])[OH:68])[OH:71])[OH:69]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)21
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58506
chebi:58506
CZGUSIXMZVURDU-JZXHSEFVSA-N 		angiotensin II
Ile(5)-angiotensin II dizwitterion

kegg.drug:D02014
keggD:D02014
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Angiotensin II (USAN)
Angiotensin II (human type) (JAN)
Delivert (TN)
hmdb:HMDB0001035
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Angiotensin II
(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S,2S)-1-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]carbamoyl}-2-methylbutyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-[(diaminomethylidene)amino]butyl]carbamoyl}propanoic acid
(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S,2S)-1-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-3-(3H-imidazol-4-yl)-1-oxopropan-2-yl]carbamoyl}-2-methylbutyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-[(diaminomethylidene)amino]butyl]carbamoyl}propanoic acid
1-8-Angiotensin I
1-L-Aspasaginyl-5-L-valyl angiotensin octapeptide
5 L Isoleucine angiotensin II
5-Isoleucine-angiotensin II
5-L-Isoleucine angiotensin II
5-L-Isoleucineangiotensin II
ANG-(1-8)octapeptide
Ang II
Angiotensin
Angiotensin 2
Angiotensin II (human)
Angiotensin II (mouse)
Angiotensin II, 5-L-isoleucine
Angiotensin-(1-8) octapeptide
Angiotonin
Asp-arg-val-tyr-ile-his-pro-phe
Delivert
Human angiotensin II
Hypertensin
II, 5-L-isoleucine angiotensin
Ile(5)-angiotensin II
Isoleucine(5)-angiotensin
Isoleucine(5)-angiotensin II
Isoleucyl(5)-angiotensin II
N-(1-(N-(N-(N-(N-(N(2)-L-a-Aspartyl-L-arginyl)-L-valyl)-L-tyrosyl)-L-isoleucyl)-L-histidyl)-L-prolyl)-L-phenylalanine
N-(1-(N-(N-(N-(N-(N(2)-L-alpha-Aspartyl-L-arginyl)-L-valyl)-L-tyrosyl)-L-isoleucyl)-L-histidyl)-L-prolyl)-L-phenylalanine
N-(1-(N-(N-(N-(N-(N(2)-L-alpha-aspartyl-L-arginyl)-L-valyl)-L-tyrosyl)-L-isoleucyl)-L-histidyl)-L-prolyl)-L-phenylalanine
Valyl(5)-angiotensin II

kegg.compound:C02135
keggC:C02135
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Angiotensin II
Angiotensin
Angiotonin
Hypertensin

sabiork.compound:6021
sabiorkM:6021
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Angiotensin II
Asp-Arg-Val-Tyr-Ile-His-Pro-Phe
DRVYIHPF

seed.compound:cpd01445
seedM:cpd01445
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Angiotonin
Angiotensin
Angiotensin II
Hypertensin
angiotensin II

CHEBI:2719
chebi:2719
CZGUSIXMZVURDU-JZXHSEFVSA-N 		Ile(5)-angiotensin II
5-L-isoleucineangiotensin II
5-isoleucine-angiotensin II
Angiotensin
Angiotensin II
Angiotonin
Asp-Arg-Val-Tyr-Ile-His-Pro-Phe
Hypertensin
L-alpha-aspartyl-L-arginyl-L-valyl-L-tyrosyl-L-isoleucyl-L-histidyl-L-prolyl-L-phenylalanine
N-(1-(N-(N-(N-(N-(N(2)-L-alpha-aspartyl-L-arginyl)-L-valyl)-L-tyrosyl)-L-isoleucyl)-L-histidyl)-L-prolyl)-L-phenylalanine
angiotensin II
angiotensin II (human)
angiotensin II (mouse)
human angiotensin II
isoleucine(5)-angiotensin II

CHEBI:48432
chebi:48432 		angiotensin II
1-8-angiotensin I
ang II
angiotensina II
angiotensinum II

metacyc.compound:CPD-12082
metacycM:CPD-12082
CZGUSIXMZVURDU-JZXHSEFVSA-N 		angiotensin-2
Asp-Arg-Val-Tyr-Ile-His-Pro-Phe
angiotensin II

hmdb:HMDB01035
chebi:131170
keggC:M_C02135
keggD:M_D02014
seedM:M_cpd01445 		secondary/obsolete/fantasy identifier