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1 hit(s) found in 0.10 seconds
Search term: YVLPJIGOMTXXLP-KEKOKYSKBV
Found by InChIKey (full match)
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ChemSpider ID: |
4444344
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Empirical Formula: |
C40H64
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Molecular Weight: |
544.9362
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Nominal Mass: |
544
Da
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Average Mass: |
544.9362
Da
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Monoisotopic Mass: |
544.500802
Da
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Systematic Name: |
7,7',8,8',11,11',12,12'-octahydro-psi,psi-carotene
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SMILES: |
C(=C/CCC(=C\C=C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)C)\C)(\CC/C=C(/CC/C=C(\C)C)C)C
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InChI: |
InChI=1/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
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InChIKey: |
YVLPJIGOMTXXLP-KEKOKYSKBV
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Std. InChI: |
InChI=1S/C40H64/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,19-22,27-30H,13-18,23-26,31-32H2,1-10H3/b12-11+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
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Std. InChIKey: |
YVLPJIGOMTXXLP-KEKOKYSKSA-N
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users,
Redirected by Users, Redirect Approved by Experts
.psi.,.psi.-Carotene, 7,7',8,8',11,11',12,12'-octahydro-
13920-14-4
[RN]
prephytoene diphosphate
(6E,10E,14E,16E,18E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,22,26,30-nonaene
13832-75-2
[RN]
1845455
[Beilstein]
540-04-5
[RN]
7,7',8,8',11,11',12,12'-octahydro-psi,psi-carotene
7,8,11,12,7',8',11',12'-octahydro-psi,psi-carotene
7696-40-4
[RN]
More...
all-trans-phytoene
Lycopene, 7,7',8,8',11,11',12,12'-octahydro-, all-trans-
phytoene
psi,psi-carotene, 7,7',8,8',11,11',12,12'-octahydro-
Less...
Edit
Validated by Experts, Validated by Users, Non-Validated, Removed by Users,
Redirected by Users, Redirect Approved by Experts
C05413
CHEBI:8191
NSC 378840
NSC378840
Descriptors:
0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 54, 0, 0, 10, 0, 0, 0, 0, 18, 0, 0, 0
| Category | Target | PDB Code | LASSO Score |
| Nuclear Hormone Receptors | RXRa, retinoic X receptor R | 1mvc | 0.90 |
| Nuclear Hormone Receptors | AR, androgen receptor | 1xq2 | 0.42 |
| Other Enzymes | HMGR, hydroxymethylglutaryl-CoA reductase | 1hw8 | 0.39 |
| Nuclear Hormone Receptors | PR, progesterone receptor | 1sr7 | 0.29 |
| Kinases | FGFr1, fibroblast growth factor receptor kinase | 1agw | 0.26 |
| Nuclear Hormone Receptors | GR, glucocorticoid receptor | 1m2z | 0.10 |
| Nuclear Hormone Receptors | ER, estrogen receptor; antagonist | 3ert | 0.03 |
| Metalloenzymes | ACE, angiotensin-converting enzyme | 1o86 | 0.03 |
| Nuclear Hormone Receptors | PPARg, peroxisome proliferator activated receptor | 1fm9 | 0.02 |
| Nuclear Hormone Receptors | ER, estrogen receptor; agonist | 1l2i | 0.02 |
| Kinases | PDGFrb, platelet derived growth factor receptor kinase | N/A | 0.02 |
| Kinases | SRC, tyrosine kinase SRC | 2src | 0.01 |
| Serine Proteases | Thrombin | 1ba8 | 0.01 |
| Other Enzymes | HIVPR, HIV protease | 1hpx | 0.01 |
| Metalloenzymes | PDE5, phosphodiesterase 5 | 1xp0 | 0.01 |
| Nuclear Hormone Receptors | MR, mineralocorticoid receptor | 2aa2 | 0.01 |
| Other Enzymes | PARP, poly(ADP-ribose) polymerase | 1efy | 0.01 |
| Other Enzymes | PNP, purine nucleoside phosphorylase | 1b8o | 0.01 |
| Folate Enzymes | DHFR, dihydrofolate reductase | 3dfr | 0.00 |
| Other Enzymes | NA, neuraminidase | 1a4g | 0.00 |
| Other Enzymes | AmpC, AmpC beta-lactamase | 1xgj | 0.00 |
| Other Enzymes | InhA, enoyl ACP reductase | 1p44 | 0.00 |
| Other Enzymes | GPB, glycogen phosphorylase | 1a8i | 0.00 |
| Serine Proteases | Trypsin | 1bju | 0.00 |
| Kinases | VEGFr2, vascular endothelial growth factor receptor | 1vr2 | 0.00 |
| Other Enzymes | HIVRT, HIV reverse transcriptase | 1rt1 | 0.00 |
| Other Enzymes | COX-2, cyclooxygenase-2 | 1cx2 | 0.00 |
| Metalloenzymes | COMT, catechol O-methyltransferase | 1h1d | 0.00 |
| Other Enzymes | ALR2, aldose reductase | 1ah3 | 0.00 |
| Kinases | CDK2, cyclindependent kinase 2 | 1ckp | 0.00 |
| Other Enzymes | COX-1, cyclooxygenase-1 | 1p4g | 0.00 |
| Metalloenzymes | ADA, adenosine deaminase | 1stw | 0.00 |
| Kinases | P38 MAP, P38 mitogen activated protein | 1kv2 | 0.00 |
| Other Enzymes | AChE, acetylcholinesterase | 1eve | 0.00 |
| Folate Enzymes | GART, glycinamide ribonucleotide transformylase | 1c2t | 0.00 |
| Other Enzymes | SAHH, S-adenosyl-homocysteine hydrolase | 1a7a | 0.00 |
| Kinases | HSP90, human heat shock protein 90 | 1uy6 | 0.00 |
| Kinases | EGFr, epidermal growth factor receptor | 1m17 | 0.00 |
| Serine Proteases | FXa, factor Xa | 1f0r | 0.00 |
| Kinases | TK, thymidine kinase | 1kim | 0.00 |
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