Mevastatin

C₂₃H₃₄O₅CAS 73573-88-3390.52 g/mol

Open in Covalent MOL file

Alcohol Alkene Ester Lactone

Properties

Molecular formula: C₂₃H₃₄O₅
Molar mass: 390.52 g/mol
Exact mass: 390.2406 Da
Melting point: 152 °C
logP: 3.95Crippen estimate
Polar surface area: 72.8 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 6
Stereocentres: S, S, S, S, R, R, Rin SMILES atom order

Hazards

Danger

H317 May cause an allergic skin reaction50% of notifiers
H351 Suspected of causing cancer50% of notifiers
H360 May damage fertility or the unborn child50% of notifiers
H362 May cause harm to breast-fed children50% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure50% of notifiers
H412 Harmful to aquatic life with long lasting effects50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P261, P263, P264, P270, P272, P273, P280, P302+P352, P318, P319, P321, P333+P317, P362+P364, P405, P501

Identifiers

CAS number

73573-88-3

SMILES

CC[C@H](C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21

InChIKey

AJLFOPYRIVGYMJ-INTXDZFKSA-N

InChI

InChI=1S/C23H34O5/c1-4-14(2)23(26)28-20-7-5-6-16-9-8-15(3)19(22(16)20)11-10-18-12-17(24)13-21(25)27-18/h6,8-9,14-15,17-20,22,24H,4-5,7,10-13H2,1-3H3/t14-,15-,17+,18+,19-,20-,22-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all

Butanoic acid, 2-methyl-, (1S,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-7-methyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, (2S)-
Butanoic acid, 2-methyl-, 1,2,3,7,8,8a-hexahydro-7-methyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1α(R*),7β,8β(2S*,4S*),8aβ]]-
Compactin (penicillium)
ML 236B
CS 500
(+)-Compactin
ML 236B lactone
Antibiotic ML 236B
Compactin
CS 500 (antibiotic)
L 637312
Statin I
NSC 281245

Work with Mevastatin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Lovastatin75330-75-578 % similar Pravastatin81093-37-057 % similar Lovastatin sodium salt75225-50-254 % similar Pravastatin sodium81131-70-654 % similar Simvastatin79902-63-953 % similar Simvastatin ammonium salt139893-43-936 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tussilagone104012-37-5 Digoxigenin1672-46-4 Latanoprost acid41639-83-2 Periplogenin514-39-6 Treprostinil81846-19-7

Elsewhere

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