PEPTIDE CORPUS

Cardiovascular & General

Apelin

Space-filling model of Apelin

Last updated

Evidence on file2 human observational studies · 2 citations not yet graded
Strongest sourceNCT00901719: Investigating the Interaction of Apelin and Systemic Angiotensin II Peripheral Resistance Vessel… (human observational study)

Dosing on file unverified

IV: 1, 10, 100 nmol/min escalating; 30 nmol/min; Intra-arterial: 0.3, 1.0, 3.0 nmol/min; 30, 100, 300 nmol/min × 5min; Intra-arterial: 0.1, 1.0, 3.0 nmol/min × 6min; [Pyr1]apelin-13: 1 or 10 nmol/mL × 3h

Carried from a source that labels it unverified, and reproduced with that label attached. A record of what is reported, not a recommendation. No citation on this page establishes it.

Literature on file 4

Not graded

2 citations whose study design could not be read from the title. Left ungraded rather than guessed at.

Identity

PubChem CID 56841713 computed 3D conformer Space-filling 3D model of Apelin, carbon grey, nitrogen blue, oxygen red
Built from the SMILES on this record — the atoms, bonds and stereochemistry are exact. The shape is one computed low-energy pose, not a measured structure: a flexible peptide in solution has no single conformation. The skeletal formula below claims connectivity and nothing more, which is what we actually know.
Skeletal formulathe canonical depiction
2D chemical structure of Apelin

Drawn by PubChem from CID 56841713, the identifier on this record.

Molecular weight
6156
Molecular formula
C266H427N95O71S2
CAS number
372170-33-7
PubChem CID
56841713
UniProt
Q9ULZ1 (precursor)
InChI key
BWVPHIKGXQBZPV-QKFDDRBGSA-N
SMILES
CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N)C(=O)NCC(=O)N3CCC[C@H]3C(=O)NCC(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC7=CC=CC=C7)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC9=CN=CN9)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CN
InChI
InChI=1S/C266H427N95O71S2/c1-135(2)102-166(318-201(374)123-309-216(390)174(112-195(273)368)319-202(375)124-311-219(393)178(116-210(385)386)348-247(421)189-68-45-99-361(189)256(430)179(106-139(9)10)349-248(422)190-69-43-97-359(190)254(428)164(79-100-433-15)336-231(405)167(103-136(3)4)341-240(414)181(130-362)321-198(371)117-269)230(404)331-161(74-78-208(381)382)229(403)346-177(115-209(383)384)218(392)310-125-203(376)320-176(114-197(275)370)238(412)353-211(140(11)12)250(424)334-158(61-36-90-303-265(290)291)227(401)343-173(111-146-120-295-134-316-146)236(410)340-169(105-138(7)8)237(411)352-212(141(13)14)251(425)338-163(73-77-194(272)367)253(427)358-96-42-66-187(358)245(419)332-150(54-29-83-296-258(276)277)213(387)308-126-204(377)322-182(131-363)239(413)328-156(59-34-88-301-263(286)287)225(399)345-175(113-196(274)369)217(391)313-128-205(378)354-92-38-63-184(354)242(416)314-129-207(380)356-94-40-65-186(356)244(418)347-171(109-144-118-305-148-51-24-23-50-147(144)148)234(408)329-159(71-75-192(270)365)215(389)307-121-199(372)306-122-200(373)317-151(55-30-84-297-259(278)279)220(394)325-153(56-31-85-298-260(280)281)221(395)324-152(53-26-28-82-268)224(398)342-170(107-142-46-19-17-20-47-142)233(407)327-155(58-33-87-300-262(284)285)222(396)326-154(57-32-86-299-261(282)283)223(397)330-160(72-76-193(271)366)228(402)335-162(62-37-91-304-266(292)293)252(426)357-95-41-67-188(357)246(420)333-157(60-35-89-302-264(288)289)226(400)339-168(104-137(5)6)232(406)351-183(132-364)241(415)344-172(110-145-119-294-133-315-145)235(409)323-149(52-25-27-81-267)214(388)312-127-206(379)355-93-39-64-185(355)243(417)337-165(80-101-434-16)255(429)360-98-44-70-191(360)249(423)350-180(257(431)432)108-143-48-21-18-22-49-143/h17-24,46-51,118-120,133-141,149-191,211-212,305,362-364H,25-45,52-117,121-132,267-269H2,1-16H3,(H2,270,365)(H2,271,366)(H2,272,367)(H2,273,368)(H2,274,369)(H2,275,370)(H,294,315)(H,295,316)(H,306,372)(H,307,389)(H,308,387)(H,309,390)(H,310,392)(H,311,393)(H,312,388)(H,313,391)(H,314,416)(H,317,373)(H,318,374)(H,319,375)(H,320,376)(H,321,371)(H,322,377)(H,323,409)(H,324,395)(H,325,394)(H,326,396)(H,327,407)(H,328,413)(H,329,408)(H,330,397)(H,331,404)(H,332,419)(H,333,420)(H,334,424)(H,335,402)(H,336,405)(H,337,417)(H,338,425)(H,339,400)(H,340,410)(H,341,414)(H,342,398)(H,343,401)(H,344,415)(H,345,399)(H,346,403)(H,347,418)(H,348,421)(H,349,422)(H,350,423)(H,351,406)(H,352,411)(H,353,412)(H,381,382)(H,383,384)(H,385,386)(H,431,432)(H4,276,277,296)(H4,278,279,297)(H4,280,281,298)(H4,282,283,299)(H4,284,285,300)(H4,286,287,301)(H4,288,289,302)(H4,290,291,303)(H4,292,293,304)/t149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,161-,162-,163-,164-,165-,166-,167-,168-,169-,170-,171-,172-,173-,174-,175-,176-,177-,178-,179-,180-,181-,182-,183-,184-,185-,186-,187-,188-,189-,190-,191-,211-,212-/m0/s1

Notes unverified prose

Multiple Phase 1 human studies; NCT00901719; NCT02150694; Phase 1 human studies

Not on file 1

1 of the 8 fields we track hold nothing on this record, and each says why. A blank field is a bug; a named absence is a finding.

Each field links to every other record missing the same thing. The full ledger holds 521 gaps across 136 records.

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Share card for Apelin: structure, evidence rung and sources on file
www.peptidecorpus.com/peptides/apelin